Isoxazole

Aromatische organische heterozyklische Verbindungen, die aus einem Azol mit einem Stickstoffatom und einem Sauerstoffatom mit der Formel bestehen: C3H3NO.

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2-Methyl-2-Phenylpropylmagnesiumchlorid, M-Lösung in Diethylether, AcroSeal™, Thermo Scientific Chemicals

CAS: 35293-35-7 Summenformel: C10H13ClMg Molekulargewicht (g/mol): 192.97 MDL-Nummer: MFCD00075586 InChI-Schlüssel: BXKYFONHSSFLKR-UHFFFAOYSA-M Synonym: neophylmagnesium chloride,chloro 2-methyl-2-phenylpropyl magnesium,magnesium, chloro 2-methyl-2-phenylpropyl,2-methyl-2-phenylpropylmagnesium chloride,2-methyl-2-phenylpropylmagnesium chloride solution,neophyl magnesium chloride,bxkyfonhssflkr-uhfffaoysa-m,2-methyl-2-phenylpropyl magnesium chloride,2-methyl-2-phenyl-propanyl magnesium chloride,2-methyl-2-phenylpropylmagnesium chloride solution, 0.5 m in diethyl ether PubChem CID: 118802 IUPAC-Name: chloro(2-methyl-2-phenylpropyl)magnesium SMILES: CC(C)(C[Mg]Cl)C1=CC=CC=C1

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InChI-Schlüssel	BXKYFONHSSFLKR-UHFFFAOYSA-M
IUPAC-Name	chloro(2-methyl-2-phenylpropyl)magnesium
PubChem CID	118802
CAS	35293-35-7
MDL-Nummer	MFCD00075586
Molekulargewicht (g/mol)	192.97
SMILES	CC(C)(C[Mg]Cl)C1=CC=CC=C1
Synonym	neophylmagnesium chloride,chloro 2-methyl-2-phenylpropyl magnesium,magnesium, chloro 2-methyl-2-phenylpropyl,2-methyl-2-phenylpropylmagnesium chloride,2-methyl-2-phenylpropylmagnesium chloride solution,neophyl magnesium chloride,bxkyfonhssflkr-uhfffaoysa-m,2-methyl-2-phenylpropyl magnesium chloride,2-methyl-2-phenyl-propanyl magnesium chloride,2-methyl-2-phenylpropylmagnesium chloride solution, 0.5 m in diethyl ether
Summenformel	C10H13ClMg

Sulfisoxazol, 99 %, Thermo Scientific Chemicals

CAS: 127-69-5 Summenformel: C₁₁H₁₃N₃O₃S Molekulargewicht (g/mol): 267.3 InChI-Schlüssel: NHUHCSRWZMLRLA-UHFFFAOYSA-N Synonym: sulfisoxazole,sulfafurazole,sulphafurazole,sulfisoxazol,sulfafurazol,sulfaisoxazole,sulfofurazole,sulfisoxasole,sulphaisoxazole,sulfadimethylisoxazole PubChem CID: 5344 ChEBI: CHEBI:102484 IUPAC-Name: 4-Amino-N-(3,4-Dimethyl-1,2-Oxazol-5-yl)Benzolsulfonamid SMILES: CC1=C(ON=C1C)NS(=O)(=O)C2=CC=C(C=C2)N

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InChI-Schlüssel	NHUHCSRWZMLRLA-UHFFFAOYSA-N
IUPAC-Name	4-Amino-N-(3,4-Dimethyl-1,2-Oxazol-5-yl)Benzolsulfonamid
PubChem CID	5344
CAS	127-69-5
ChEBI	CHEBI:102484
Molekulargewicht (g/mol)	267.3
SMILES	CC1=C(ON=C1C)NS(=O)(=O)C2=CC=C(C=C2)N
Synonym	sulfisoxazole,sulfafurazole,sulphafurazole,sulfisoxazol,sulfafurazol,sulfaisoxazole,sulfofurazole,sulfisoxasole,sulphaisoxazole,sulfadimethylisoxazole
Summenformel	C₁₁H₁₃N₃O₃S

3-Hydroxy-5-methylisoxazol, 97 %, Thermo Scientific Chemicals

CAS: 10004-44-1 Summenformel: C4H5NO2 Molekulargewicht (g/mol): 99.089 MDL-Nummer: MFCD00144468 InChI-Schlüssel: KGVPNLBXJKTABS-UHFFFAOYSA-N Synonym: hymexazol,3-hydroxy-5-methylisoxazole,hymexazole,5-methylisoxazol-3-ol,5-methylisoxazol-3 2h-one,hydroxyisoxazole,tachigaren,itachigarden,5-methyl-3-hydroxyisoxazole,5-methyl-3 2h-isoxazolone PubChem CID: 24781 ChEBI: CHEBI:5827 IUPAC-Name: 5-;ethyl-1,2-Oxazol-3-on SMILES: CC1=CC(=O)NO1

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InChI-Schlüssel	KGVPNLBXJKTABS-UHFFFAOYSA-N
IUPAC-Name	5-;ethyl-1,2-Oxazol-3-on
PubChem CID	24781
CAS	10004-44-1
ChEBI	CHEBI:5827
MDL-Nummer	MFCD00144468
Molekulargewicht (g/mol)	99.089
SMILES	CC1=CC(=O)NO1
Synonym	hymexazol,3-hydroxy-5-methylisoxazole,hymexazole,5-methylisoxazol-3-ol,5-methylisoxazol-3 2h-one,hydroxyisoxazole,tachigaren,itachigarden,5-methyl-3-hydroxyisoxazole,5-methyl-3 2h-isoxazolone
Summenformel	C4H5NO2

5-Methylisoxazol-3-carbonsäure, ≥ 98 %, Thermo Scientific Chemicals

CAS: 3405-77-4 Summenformel: C5H5NO3 Molekulargewicht (g/mol): 127.099 MDL-Nummer: MFCD01318162 InChI-Schlüssel: BNMPIJWVMVNSRD-UHFFFAOYSA-N Synonym: 5-methylisoxazole-3-carboxylic acid,5-methylisoxazole-3-carboxylicacid,3-isoxazolecarboxylic acid, 5-methyl,5-methyl-3-isoxazolecarboxylic acid,5-methyl-isoxazole-3-carboxylic acid,3-carboxy-5-methylisoxazole,3-isoxazolecarboxylicacid, 5-methyl,isoxazole acid,pubchem15552,ksc224c5p PubChem CID: 76947 IUPAC-Name: 5-Methyl-1,2-Oxazol-3-Carbonsäure SMILES: CC1=CC(=NO1)C(=O)O

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InChI-Schlüssel	BNMPIJWVMVNSRD-UHFFFAOYSA-N
IUPAC-Name	5-Methyl-1,2-Oxazol-3-Carbonsäure
PubChem CID	76947
CAS	3405-77-4
MDL-Nummer	MFCD01318162
Molekulargewicht (g/mol)	127.099
SMILES	CC1=CC(=NO1)C(=O)O
Synonym	5-methylisoxazole-3-carboxylic acid,5-methylisoxazole-3-carboxylicacid,3-isoxazolecarboxylic acid, 5-methyl,5-methyl-3-isoxazolecarboxylic acid,5-methyl-isoxazole-3-carboxylic acid,3-carboxy-5-methylisoxazole,3-isoxazolecarboxylicacid, 5-methyl,isoxazole acid,pubchem15552,ksc224c5p
Summenformel	C5H5NO3

5-Methyl-4-isoxazolsulfonylchlorid, 95 %, Thermo Scientific™

CAS: 321309-26-6 Summenformel: C4H4ClNO3S Molekulargewicht (g/mol): 181.59 MDL-Nummer: MFCD02681975 InChI-Schlüssel: STYUNYVEEFPQMF-UHFFFAOYSA-N Synonym: 5-methyl-4-isoxazolesulfonyl chloride,5-methylisoxazole-4-sulfonyl chloride,4-isoxazolesulfonyl chloride, 5-methyl,4-chlorosulfonyl-5-methylisoxazole,chloro 5-methylisoxazol-4-yl sulfone,4-chlorosulphonyl-5-methylisoxazole,4-isoxazolesulfonylchloride, 5-methyl,5-methyl-4-isoxazole sulfonyl chloride,5-methyl-isoxazole-4-sulfonyl chloride,5-methylisoxazole-4-sulphonyl chloride PubChem CID: 2776141 IUPAC-Name: 5-Methyl-1,2-Oxazol-4-Sulfonylchlorid SMILES: CC1=C(C=NO1)S(=O)(=O)Cl

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InChI-Schlüssel	STYUNYVEEFPQMF-UHFFFAOYSA-N
IUPAC-Name	5-Methyl-1,2-Oxazol-4-Sulfonylchlorid
PubChem CID	2776141
CAS	321309-26-6
MDL-Nummer	MFCD02681975
Molekulargewicht (g/mol)	181.59
SMILES	CC1=C(C=NO1)S(=O)(=O)Cl
Synonym	5-methyl-4-isoxazolesulfonyl chloride,5-methylisoxazole-4-sulfonyl chloride,4-isoxazolesulfonyl chloride, 5-methyl,4-chlorosulfonyl-5-methylisoxazole,chloro 5-methylisoxazol-4-yl sulfone,4-chlorosulphonyl-5-methylisoxazole,4-isoxazolesulfonylchloride, 5-methyl,5-methyl-4-isoxazole sulfonyl chloride,5-methyl-isoxazole-4-sulfonyl chloride,5-methylisoxazole-4-sulphonyl chloride
Summenformel	C4H4ClNO3S

Benzo[d]isoxazol-3-ol, ≥ 95 %, Thermo Scientific™

CAS: 21725-69-9 Summenformel: C7H5NO2 Molekulargewicht (g/mol): 135.122 MDL-Nummer: MFCD00125030 InChI-Schlüssel: QLDQYRDCPNBPII-UHFFFAOYSA-N Synonym: benzo d isoxazol-3-ol,1,2-benzisoxazol-3 2h-one,1,2-benzoxazol-3-ol,1,2-benzisoxazol-3-ol,3-hydroxybenzisoxazole,3-hydroxy-1,2-benzisoxazole,1,2-benzisoxazolin-3-one,1,2-benzisoxazol-3-ol 8ci,2h-1,2-benzoxazol-3-one,benzisoxazolone PubChem CID: 210830 IUPAC-Name: 1,2-Benzoxazol-3-on SMILES: C1=CC=C2C(=C1)C(=O)NO2

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InChI-Schlüssel	QLDQYRDCPNBPII-UHFFFAOYSA-N
IUPAC-Name	1,2-Benzoxazol-3-on
PubChem CID	210830
CAS	21725-69-9
MDL-Nummer	MFCD00125030
Molekulargewicht (g/mol)	135.122
SMILES	C1=CC=C2C(=C1)C(=O)NO2
Synonym	benzo d isoxazol-3-ol,1,2-benzisoxazol-3 2h-one,1,2-benzoxazol-3-ol,1,2-benzisoxazol-3-ol,3-hydroxybenzisoxazole,3-hydroxy-1,2-benzisoxazole,1,2-benzisoxazolin-3-one,1,2-benzisoxazol-3-ol 8ci,2h-1,2-benzoxazol-3-one,benzisoxazolone
Summenformel	C7H5NO2

[5-(2-Furyl)isoxazol-3-yl]methanol, ≥97 %, Thermo Scientific™

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3-(Chlormethyl)-5-methylisoxazol, 97 %, Thermo Scientific™

CAS: 35166-37-1 Summenformel: C5H6ClNO Molekulargewicht (g/mol): 131.56 MDL-Nummer: MFCD00221166 InChI-Schlüssel: FEXTXBAFBURKGS-UHFFFAOYSA-N Synonym: 3-chloromethyl-5-methylisoxazole,3-chloromethyl-5-methyl-1,2-oxazole,3-chloromethyl-5-methyl-isoxazole,pubchem8710,zlchem 1024,acmc-209idp,3-chloromethyl-5-methyisoxazole,3-choromethyl-5-methylisoxazole,5-methyl-3-chloromethylisoxazole PubChem CID: 2735763 IUPAC-Name: 3-(Chlormethyl)-5-methyl-1,2-oxazol SMILES: CC1=CC(CCl)=NO1

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InChI-Schlüssel	FEXTXBAFBURKGS-UHFFFAOYSA-N
IUPAC-Name	3-(Chlormethyl)-5-methyl-1,2-oxazol
PubChem CID	2735763
CAS	35166-37-1
MDL-Nummer	MFCD00221166
Molekulargewicht (g/mol)	131.56
SMILES	CC1=CC(CCl)=NO1
Synonym	3-chloromethyl-5-methylisoxazole,3-chloromethyl-5-methyl-1,2-oxazole,3-chloromethyl-5-methyl-isoxazole,pubchem8710,zlchem 1024,acmc-209idp,3-chloromethyl-5-methyisoxazole,3-choromethyl-5-methylisoxazole,5-methyl-3-chloromethylisoxazole
Summenformel	C5H6ClNO

4-(Chloromethyl)-3-(2,6-dichlorphenyl)-5-methylisoxazol, 97 %, Thermo Scientific™

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3-Ethyl-5-methylisoxazol-4-carbonsäure, 97 %, Thermo Scientific Chemicals

CAS: 17147-85-2 Summenformel: C7H9NO3 Molekulargewicht (g/mol): 155.153 MDL-Nummer: MFCD03422293 InChI-Schlüssel: RSWFHHWVFZWIMV-UHFFFAOYSA-N Synonym: 3-ethyl-5-methylisoxazole-4-carboxylic acid,3-ethyl-5-methyl-isoxazole-4-carboxylic acid,3-ethyl-5-methyl-4-isoxazolecarboxylic acid,4-isoxazolecarboxylic acid, 3-ethyl-5-methyl,acmc-1c8pz,4-isoxazolecarboxylicacid,3-ethyl-5-methyl,4-isoxazolecarboxylicacid, 3-ethyl-5-methyl,4-isoxazolecarboxylic acid, 3-ethyl-5-methyl-8ci,9ci PubChem CID: 2063310 IUPAC-Name: 3-Ethyl-5-Methyl-1,2-Oxazol-4-Carbonsäure SMILES: CCC1=NOC(=C1C(=O)O)C

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InChI-Schlüssel	RSWFHHWVFZWIMV-UHFFFAOYSA-N
IUPAC-Name	3-Ethyl-5-Methyl-1,2-Oxazol-4-Carbonsäure
PubChem CID	2063310
CAS	17147-85-2
MDL-Nummer	MFCD03422293
Molekulargewicht (g/mol)	155.153
SMILES	CCC1=NOC(=C1C(=O)O)C
Synonym	3-ethyl-5-methylisoxazole-4-carboxylic acid,3-ethyl-5-methyl-isoxazole-4-carboxylic acid,3-ethyl-5-methyl-4-isoxazolecarboxylic acid,4-isoxazolecarboxylic acid, 3-ethyl-5-methyl,acmc-1c8pz,4-isoxazolecarboxylicacid,3-ethyl-5-methyl,4-isoxazolecarboxylicacid, 3-ethyl-5-methyl,4-isoxazolecarboxylic acid, 3-ethyl-5-methyl-8ci,9ci
Summenformel	C7H9NO3

Ethyl-3,5-dimethylisoxazol-4-carboxylat, 97 %, Thermo Scientific Chemicals

CAS: 17147-42-1 Summenformel: C8H11NO3 Molekulargewicht (g/mol): 169.18 MDL-Nummer: MFCD00052557 InChI-Schlüssel: OQRHVDXUJAQVNT-UHFFFAOYSA-N Synonym: ethyl 3,5-dimethylisoxazole-4-carboxylate,ethyl 3,5-dimethyl-4-isoxazolecarboxylate,3,5-dimethylisoxazole-4-carboxylic acid ethyl ester,4-isoxazolecarboxylic acid, 3,5-dimethyl-, ethyl ester,3,5-dimethyl-4-ethoxycarbonyl isoxazole,ethyl 3,5-dimethyl-isoxazole-4-carboxylate,acmc-1c48c,ethyldimethylisoxazolecarboxylate,4-carbethoxy-3,5-dimethylisoxazole,4-carboethoxy-3,5-dimethylisoxazole PubChem CID: 736348 IUPAC-Name: Ethyl 3,5-Dimethyl-1,2-Oxazol-4-Carboxylat SMILES: CCOC(=O)C1=C(ON=C1C)C

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InChI-Schlüssel	OQRHVDXUJAQVNT-UHFFFAOYSA-N
IUPAC-Name	Ethyl 3,5-Dimethyl-1,2-Oxazol-4-Carboxylat
PubChem CID	736348
CAS	17147-42-1
MDL-Nummer	MFCD00052557
Molekulargewicht (g/mol)	169.18
SMILES	CCOC(=O)C1=C(ON=C1C)C
Synonym	ethyl 3,5-dimethylisoxazole-4-carboxylate,ethyl 3,5-dimethyl-4-isoxazolecarboxylate,3,5-dimethylisoxazole-4-carboxylic acid ethyl ester,4-isoxazolecarboxylic acid, 3,5-dimethyl-, ethyl ester,3,5-dimethyl-4-ethoxycarbonyl isoxazole,ethyl 3,5-dimethyl-isoxazole-4-carboxylate,acmc-1c48c,ethyldimethylisoxazolecarboxylate,4-carbethoxy-3,5-dimethylisoxazole,4-carboethoxy-3,5-dimethylisoxazole
Summenformel	C8H11NO3

Methylisoxazol-5-carboxylat, 97 %, Thermo Scientific Chemicals

CAS: 15055-81-9 Summenformel: C5H5NO3 Molekulargewicht (g/mol): 127.099 MDL-Nummer: MFCD01570794 InChI-Schlüssel: ILPCPKZAAQXHKL-UHFFFAOYSA-N Synonym: methyl isoxazole-5-carboxylate,5-isoxazolecarboxylic acid, methyl ester,isoxazole-5-carboxylic acid methyl ester,acmc-209wih,methyl 5-isoxazolcarboxylate,methyl 5-isoxazolcarboxylate;,methylisoxazole-5-carboxylate,5-methoxycarbonyl-1,2-oxazol,5-isoxazol-carbonsaeure-methylester;,isoxazol-5-carbonsaeure-methylester; PubChem CID: 2736892 IUPAC-Name: Methyl 1,2-Oxazol-5-Carboxylat SMILES: COC(=O)C1=CC=NO1

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InChI-Schlüssel	ILPCPKZAAQXHKL-UHFFFAOYSA-N
IUPAC-Name	Methyl 1,2-Oxazol-5-Carboxylat
PubChem CID	2736892
CAS	15055-81-9
MDL-Nummer	MFCD01570794
Molekulargewicht (g/mol)	127.099
SMILES	COC(=O)C1=CC=NO1
Synonym	methyl isoxazole-5-carboxylate,5-isoxazolecarboxylic acid, methyl ester,isoxazole-5-carboxylic acid methyl ester,acmc-209wih,methyl 5-isoxazolcarboxylate,methyl 5-isoxazolcarboxylate;,methylisoxazole-5-carboxylate,5-methoxycarbonyl-1,2-oxazol,5-isoxazol-carbonsaeure-methylester;,isoxazol-5-carbonsaeure-methylester;
Summenformel	C5H5NO3

(3 -Methylisoxazol-5-yl)methanol, 97 %, Thermo Scientific™

CAS: 14716-89-3 Summenformel: C5H7NO2 Molekulargewicht (g/mol): 113.116 MDL-Nummer: MFCD09859210 InChI-Schlüssel: OFSDWHRZVRCPBR-UHFFFAOYSA-N Synonym: 3-methylisoxazol-5-yl methanol,3-methyl-1,2-oxazol-5-yl methanol,3-methyl-5-isoxazolemethanol,5-isoxazolemethanol,3-methyl,3-methylisoxazol-5-yl methan-1-ol,3-methylisoxazole-5-methanol,5-isoxazolemethanol, 3-methyl,3-methyl-5-isoxazolyl methanol,5-hydroxymethyl-3-methylisoxazole,5-hydroxymethyl-3-methyl-isoxazole PubChem CID: 10820493 IUPAC-Name: (3-Methyl-1,2-oxazol-5-yl)methanol SMILES: CC1=NOC(=C1)CO

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InChI-Schlüssel	OFSDWHRZVRCPBR-UHFFFAOYSA-N
IUPAC-Name	(3-Methyl-1,2-oxazol-5-yl)methanol
PubChem CID	10820493
CAS	14716-89-3
MDL-Nummer	MFCD09859210
Molekulargewicht (g/mol)	113.116
SMILES	CC1=NOC(=C1)CO
Synonym	3-methylisoxazol-5-yl methanol,3-methyl-1,2-oxazol-5-yl methanol,3-methyl-5-isoxazolemethanol,5-isoxazolemethanol,3-methyl,3-methylisoxazol-5-yl methan-1-ol,3-methylisoxazole-5-methanol,5-isoxazolemethanol, 3-methyl,3-methyl-5-isoxazolyl methanol,5-hydroxymethyl-3-methylisoxazole,5-hydroxymethyl-3-methyl-isoxazole
Summenformel	C5H7NO2

5-Amino-3,4-dimethylisoxazol, 99 %, Thermo Scientific Chemicals

CAS: 19947-75-2 Summenformel: C5H8N2O Molekulargewicht (g/mol): 112.132 MDL-Nummer: MFCD00046081 InChI-Schlüssel: PYNDWPFZDQONDV-UHFFFAOYSA-N Synonym: 5-amino-3,4-dimethylisoxazole,3,4-dimethylisoxazol-5-amine,5-amino-3,4-dimethyl-isoxazole,5-isoxazolamine, 3,4-dimethyl,dimethyl-1,2-oxazol-5-amine,3,4-dimethyl-5-isoxazolamine,5-amino-3,4-dimethyl isoxazole,3,4-dimethylisoxazole-5-ylamine,3,4-dimethylisoxazol-5-ylamine,pubchem8660 PubChem CID: 88317 IUPAC-Name: 3,4-Dimethyl-1,2-Oxazol-5-Amin SMILES: CC1=C(ON=C1C)N

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InChI-Schlüssel	PYNDWPFZDQONDV-UHFFFAOYSA-N
IUPAC-Name	3,4-Dimethyl-1,2-Oxazol-5-Amin
PubChem CID	88317
CAS	19947-75-2
MDL-Nummer	MFCD00046081
Molekulargewicht (g/mol)	112.132
SMILES	CC1=C(ON=C1C)N
Synonym	5-amino-3,4-dimethylisoxazole,3,4-dimethylisoxazol-5-amine,5-amino-3,4-dimethyl-isoxazole,5-isoxazolamine, 3,4-dimethyl,dimethyl-1,2-oxazol-5-amine,3,4-dimethyl-5-isoxazolamine,5-amino-3,4-dimethyl isoxazole,3,4-dimethylisoxazole-5-ylamine,3,4-dimethylisoxazol-5-ylamine,pubchem8660
Summenformel	C5H8N2O

5-Methyl-3-phenylisoxazol-4-carbonylchlorid, 90 %, Thermo Scientific™

CAS: 16883-16-2 Summenformel: C11H8ClNO2 Molekulargewicht (g/mol): 221.64 MDL-Nummer: MFCD00052205 InChI-Schlüssel: HXEVQMXCHCDPSO-UHFFFAOYSA-N Synonym: 5-methyl-3-phenylisoxazole-4-carbonyl chloride,pmic chloride,unii-97ot2t1w6v,3-phenyl-5-methylisoxazole-4-carbonyl chloride,4-isoxazolecarbonyl chloride, 5-methyl-3-phenyl,5-methyl-3-phenyl-4-isoxazolecarbonyl chloride,3-phenyl-5-methyl-isoxazole-4-carbonyl,pubchem8723,acmc-20am25,dsstox_cid_31452 PubChem CID: 85624 IUPAC-Name: 5-Methyl-3-Phenyl-1,2-Oxazol-4-Carbonylchlorid SMILES: CC1=C(C(=NO1)C2=CC=CC=C2)C(=O)Cl

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InChI-Schlüssel	HXEVQMXCHCDPSO-UHFFFAOYSA-N
IUPAC-Name	5-Methyl-3-Phenyl-1,2-Oxazol-4-Carbonylchlorid
PubChem CID	85624
CAS	16883-16-2
MDL-Nummer	MFCD00052205
Molekulargewicht (g/mol)	221.64
SMILES	CC1=C(C(=NO1)C2=CC=CC=C2)C(=O)Cl
Synonym	5-methyl-3-phenylisoxazole-4-carbonyl chloride,pmic chloride,unii-97ot2t1w6v,3-phenyl-5-methylisoxazole-4-carbonyl chloride,4-isoxazolecarbonyl chloride, 5-methyl-3-phenyl,5-methyl-3-phenyl-4-isoxazolecarbonyl chloride,3-phenyl-5-methyl-isoxazole-4-carbonyl,pubchem8723,acmc-20am25,dsstox_cid_31452
Summenformel	C11H8ClNO2

Isoxazole

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