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

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

5-(Brommethyl)-3-phenylisoxazol, 97 %, Thermo Scientific™

CAS: 2039-50-1 Summenformel: C10H8BrNO Molekulargewicht (g/mol): 238.084 MDL-Nummer: MFCD00159724 InChI-Schlüssel: ANRMBFFXQKJEIS-UHFFFAOYSA-N PubChem CID: 2748796 IUPAC-Name: 5-(Brommethyl)-3-Phenyl-1,2-Oxazol SMILES: C1=CC=C(C=C1)C2=NOC(=C2)CBr

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InChI-Schlüssel	ANRMBFFXQKJEIS-UHFFFAOYSA-N
IUPAC-Name	5-(Brommethyl)-3-Phenyl-1,2-Oxazol
PubChem CID	2748796
CAS	2039-50-1
MDL-Nummer	MFCD00159724
Molekulargewicht (g/mol)	238.084
SMILES	C1=CC=C(C=C1)C2=NOC(=C2)CBr
Summenformel	C10H8BrNO

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

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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-Amino-3-methylisoxazol, ≥ 98 %, Thermo Scientific Chemicals

CAS: 14678-02-5 Summenformel: C4H6N2O Molekulargewicht (g/mol): 98.105 MDL-Nummer: MFCD00003151 InChI-Schlüssel: FNXYWHTZDAVRTB-UHFFFAOYSA-N Synonym: 5-amino-3-methylisoxazole,3-methylisoxazol-5-amine,5-isoxazolamine, 3-methyl,3-methyl-5-isoxazolamine,unii-0g66r1h4rw,3-methyl-isoxazol-5-ylamine,3-methylisoxazole-5-ylamine,3-methylisoxazole-5-amine,acmc-209yk8,3-methylisooxazole-5-amine PubChem CID: 84590 IUPAC-Name: 3-Methyl-1,2-Oxazol-5-Amin SMILES: CC1=NOC(=C1)N

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InChI-Schlüssel	FNXYWHTZDAVRTB-UHFFFAOYSA-N
IUPAC-Name	3-Methyl-1,2-Oxazol-5-Amin
PubChem CID	84590
CAS	14678-02-5
MDL-Nummer	MFCD00003151
Molekulargewicht (g/mol)	98.105
SMILES	CC1=NOC(=C1)N
Synonym	5-amino-3-methylisoxazole,3-methylisoxazol-5-amine,5-isoxazolamine, 3-methyl,3-methyl-5-isoxazolamine,unii-0g66r1h4rw,3-methyl-isoxazol-5-ylamine,3-methylisoxazole-5-ylamine,3-methylisoxazole-5-amine,acmc-209yk8,3-methylisooxazole-5-amine
Summenformel	C4H6N2O

Isoxazol-5-Carbonylchlorid, 97 %, Thermo Scientific Chemicals

CAS: 62348-13-4 Summenformel: C4H2ClNO2 Molekulargewicht (g/mol): 131.52 MDL-Nummer: MFCD00067868 InChI-Schlüssel: NASLINFISOTVJJ-UHFFFAOYSA-N Synonym: isoxazole-5-carbonyl chloride,5-isoxazolecarbonyl chloride,isoxazole-5-carbonylchloride,isoxazole-5-carboxylic acid chloride,acmc-1bhwq,5-isoxazolecarbonylchloride,isoxazol-5-carbonyl chloride,isoxazole-5-carbonyl-chloride,5-isoxazolecarbonyl chloride 9ci PubChem CID: 2736707 IUPAC-Name: 1,2-Oxazol-5-Carbonylchlorid SMILES: ClC(=O)C1=CC=NO1

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InChI-Schlüssel	NASLINFISOTVJJ-UHFFFAOYSA-N
IUPAC-Name	1,2-Oxazol-5-Carbonylchlorid
PubChem CID	2736707
CAS	62348-13-4
MDL-Nummer	MFCD00067868
Molekulargewicht (g/mol)	131.52
SMILES	ClC(=O)C1=CC=NO1
Synonym	isoxazole-5-carbonyl chloride,5-isoxazolecarbonyl chloride,isoxazole-5-carbonylchloride,isoxazole-5-carboxylic acid chloride,acmc-1bhwq,5-isoxazolecarbonylchloride,isoxazol-5-carbonyl chloride,isoxazole-5-carbonyl-chloride,5-isoxazolecarbonyl chloride 9ci
Summenformel	C4H2ClNO2

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

CAS: 130628-75-0 Summenformel: C5H6BrNO Molekulargewicht (g/mol): 176.01 MDL-Nummer: MFCD02677720 InChI-Schlüssel: ASGJFGPILHALRC-UHFFFAOYSA-N Synonym: 3-bromomethyl-5-methylisoxazole,3-bromomethyl-5-methyl-1,2-oxazole,3-bromomethyl-5-methyl-isoxazole,isoxazole,3-bromomethyl-5-methyl,zlchem 1313,acmc-1ca86,3-bromomethyl-5-methylisoxazol,5-brimomethyl-3-methylisoxazle PubChem CID: 2776304 IUPAC-Name: 3-(bromomethyl)-5-methyl-1,2-oxazole SMILES: CC1=CC(CBr)=NO1

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InChI-Schlüssel	ASGJFGPILHALRC-UHFFFAOYSA-N
IUPAC-Name	3-(bromomethyl)-5-methyl-1,2-oxazole
PubChem CID	2776304
CAS	130628-75-0
MDL-Nummer	MFCD02677720
Molekulargewicht (g/mol)	176.01
SMILES	CC1=CC(CBr)=NO1
Synonym	3-bromomethyl-5-methylisoxazole,3-bromomethyl-5-methyl-1,2-oxazole,3-bromomethyl-5-methyl-isoxazole,isoxazole,3-bromomethyl-5-methyl,zlchem 1313,acmc-1ca86,3-bromomethyl-5-methylisoxazol,5-brimomethyl-3-methylisoxazle
Summenformel	C5H6BrNO

Isoxazol-5-carbonsäure, 95 %, Thermo Scientific™

CAS: 21169-71-1 Summenformel: C4H3NO3 Molekulargewicht (g/mol): 113.072 MDL-Nummer: MFCD00156151 InChI-Schlüssel: MIIQJAUWHSUTIT-UHFFFAOYSA-N Synonym: isoxazole-5-carboxylic acid,5-isoxazolecarboxylic acid,isoxazole-5-carboxylicacid,5-carboxyisoxazole,pubchem8643,isoxazole-5-carboxylic,5-carboxy-1,2-oxazole,isoxazole 5-carboxylic acid,ksc207s2h PubChem CID: 2060599 IUPAC-Name: 1,2-Oxazol-5-Carbonsäure SMILES: C1=C(ON=C1)C(=O)O

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InChI-Schlüssel	MIIQJAUWHSUTIT-UHFFFAOYSA-N
IUPAC-Name	1,2-Oxazol-5-Carbonsäure
PubChem CID	2060599
CAS	21169-71-1
MDL-Nummer	MFCD00156151
Molekulargewicht (g/mol)	113.072
SMILES	C1=C(ON=C1)C(=O)O
Synonym	isoxazole-5-carboxylic acid,5-isoxazolecarboxylic acid,isoxazole-5-carboxylicacid,5-carboxyisoxazole,pubchem8643,isoxazole-5-carboxylic,5-carboxy-1,2-oxazole,isoxazole 5-carboxylic acid,ksc207s2h
Summenformel	C4H3NO3

5-Chlorbenzo[d]isoxazol-3-ol, Thermo Scientific™

CAS: 24603-63-2 Summenformel: C7H4ClNO2 Molekulargewicht (g/mol): 169.564 InChI-Schlüssel: WIZWHBRFTCYPDN-UHFFFAOYSA-N Synonym: 5-chlorobenzo d isoxazol-3-ol,5-chloro-3-hydroxybenzisoxazole,5-chloro-1,2-benzoxazol-3-ol,5-chloro-1,2-benzisoxazol-3 2h-one,1,2-benzisoxazol-3 2h-one, 5-chloro,5-chloro-2h-1,2-benzoxazol-3-one,pubchem24257,5-chloro-benzo d isoxazol-3-ol,5-chloro-benzo d isoxazol-3-one,5-chlorobenzo d isoxazol-3 2h-one PubChem CID: 3714169 IUPAC-Name: 5-Chlor-1,2-benzoxazol-3-on SMILES: C1=CC2=C(C=C1Cl)C(=O)NO2

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InChI-Schlüssel	WIZWHBRFTCYPDN-UHFFFAOYSA-N
IUPAC-Name	5-Chlor-1,2-benzoxazol-3-on
PubChem CID	3714169
CAS	24603-63-2
Molekulargewicht (g/mol)	169.564
SMILES	C1=CC2=C(C=C1Cl)C(=O)NO2
Synonym	5-chlorobenzo d isoxazol-3-ol,5-chloro-3-hydroxybenzisoxazole,5-chloro-1,2-benzoxazol-3-ol,5-chloro-1,2-benzisoxazol-3 2h-one,1,2-benzisoxazol-3 2h-one, 5-chloro,5-chloro-2h-1,2-benzoxazol-3-one,pubchem24257,5-chloro-benzo d isoxazol-3-ol,5-chloro-benzo d isoxazol-3-one,5-chlorobenzo d isoxazol-3 2h-one
Summenformel	C7H4ClNO2

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-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

Isoxazole

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