Pyrazole

Organische heterozyklische Verbindungen, die aus einem fünfgliedrigen Ring aus drei Kohlenstoffatomen und zwei benachbarten Stickstoffatomen mit folgender Formel bestehen: Câ‚ƒHâ‚ƒNâ‚‚H.

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6-Iod-1H-indazol, 97 %, Thermo Scientific™

CAS: 261953-36-0 Summenformel: C₇H₅IN₂ Molekulargewicht (g/mol): 244.03 MDL-Nummer: MFCD04114695 InChI-Schlüssel: RSGAXJZKQDNFEP-UHFFFAOYSA-N Synonym: 6-iodoindazole,1h-indazole, 6-iodo,6-iodo 1h indazole,6-iodo-indazole,pubchem18081,indazole, 6-iodo PubChem CID: 12991241 IUPAC-Name: 6-Iod-1H-Indazol SMILES: C1=CC2=C(C=C1I)NN=C2

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Technische Daten

InChI-Schlüssel	RSGAXJZKQDNFEP-UHFFFAOYSA-N
IUPAC-Name	6-Iod-1H-Indazol
PubChem CID	12991241
CAS	261953-36-0
MDL-Nummer	MFCD04114695
Molekulargewicht (g/mol)	244.03
SMILES	C1=CC2=C(C=C1I)NN=C2
Synonym	6-iodoindazole,1h-indazole, 6-iodo,6-iodo 1h indazole,6-iodo-indazole,pubchem18081,indazole, 6-iodo
Summenformel	C₇H₅IN₂

Thermo Scientific Chemicals 4-Hydroxypyrazol[3,4-d]pyrimidin, 98 %

CAS: 315-30-0 Summenformel: C5H4N4O Molekulargewicht (g/mol): 136.11 MDL-Nummer: MFCD00599413 InChI-Schlüssel: OFCNXPDARWKPPY-UHFFFAOYSA-N Synonym: allopurinol,1h-pyrazolo 3,4-d pyrimidin-4-ol,zyloprim,zyloric,lopurin,atisuril,bleminol,caplenal,uripurinol,embarin PubChem CID: 2094 ChEBI: CHEBI:40279 IUPAC-Name: 1,2-Dihydropyrazol[3,4-d]Pyrimidin-4-on SMILES: O=C1N=CN=C2NNC=C12

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Technische Daten

InChI-Schlüssel	OFCNXPDARWKPPY-UHFFFAOYSA-N
IUPAC-Name	1,2-Dihydropyrazol[3,4-d]Pyrimidin-4-on
PubChem CID	2094
CAS	315-30-0
ChEBI	CHEBI:40279
MDL-Nummer	MFCD00599413
Molekulargewicht (g/mol)	136.11
SMILES	O=C1N=CN=C2NNC=C12
Synonym	allopurinol,1h-pyrazolo 3,4-d pyrimidin-4-ol,zyloprim,zyloric,lopurin,atisuril,bleminol,caplenal,uripurinol,embarin
Summenformel	C5H4N4O

7-Nitro-1H-indazol, 98 %, Thermo Scientific Chemicals

CAS: 2942-42-9 Summenformel: C7H5N3O2 Molekulargewicht (g/mol): 163.136 MDL-Nummer: MFCD00022789 InChI-Schlüssel: PQCAUHUKTBHUSA-UHFFFAOYSA-N Synonym: 7-nitroindazole,1h-indazole, 7-nitro,7-ni,7-nitro-indazole,unii-ux0n37cmvh,ccris 3309,2h-indazole,7-nitro,ux0n37cmvh,7ni PubChem CID: 1893 IUPAC-Name: 7-Nitro-1H-Indazol SMILES: C1=CC2=C(C(=C1)[N+](=O)[O-])NN=C2

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Technische Daten

InChI-Schlüssel	PQCAUHUKTBHUSA-UHFFFAOYSA-N
IUPAC-Name	7-Nitro-1H-Indazol
PubChem CID	1893
CAS	2942-42-9
MDL-Nummer	MFCD00022789
Molekulargewicht (g/mol)	163.136
SMILES	C1=CC2=C(C(=C1)[N+](=O)[O-])NN=C2
Synonym	7-nitroindazole,1h-indazole, 7-nitro,7-ni,7-nitro-indazole,unii-ux0n37cmvh,ccris 3309,2h-indazole,7-nitro,ux0n37cmvh,7ni
Summenformel	C7H5N3O2

1-Methyl-1h-indazol-3-carbonylchlorid, 97 %, Thermo Scientific™

CAS: 106649-02-9 Summenformel: C9H7ClN2O Molekulargewicht (g/mol): 194.62 MDL-Nummer: MFCD02093096 InChI-Schlüssel: NPNWVMBPSINFBV-UHFFFAOYSA-N Synonym: 1-methyl-1h-indazole-3-carbonyl chloride,1h-indazole-3-carbonylchloride, 1-methyl,1-methyl-1h-indazol-3-carbonyl chloride,1h-indazole-3-carbonyl chloride, 1-methyl,acmc-20mac8,1-methyl-3-indazolylcarbonyl chloride,1-methyl-indazole-3-carbonyl chloride,1-methyl-1h-indazole-3-carboxychloride,1-methyl-1h-indazole-3-carboxylic acid chloride PubChem CID: 7022055 IUPAC-Name: 1-methyl-1H-indazole-3-carbonyl chloride SMILES: CN1N=C(C(Cl)=O)C2=CC=CC=C12

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Technische Daten

InChI-Schlüssel	NPNWVMBPSINFBV-UHFFFAOYSA-N
IUPAC-Name	1-methyl-1H-indazole-3-carbonyl chloride
PubChem CID	7022055
CAS	106649-02-9
MDL-Nummer	MFCD02093096
Molekulargewicht (g/mol)	194.62
SMILES	CN1N=C(C(Cl)=O)C2=CC=CC=C12
Synonym	1-methyl-1h-indazole-3-carbonyl chloride,1h-indazole-3-carbonylchloride, 1-methyl,1-methyl-1h-indazol-3-carbonyl chloride,1h-indazole-3-carbonyl chloride, 1-methyl,acmc-20mac8,1-methyl-3-indazolylcarbonyl chloride,1-methyl-indazole-3-carbonyl chloride,1-methyl-1h-indazole-3-carboxychloride,1-methyl-1h-indazole-3-carboxylic acid chloride
Summenformel	C9H7ClN2O

[5-(2-Furyl)-1-methyl-1H-pyrazol-3-yl]-methanol, ≥ 97 %, Thermo Scientific™

CAS: 876728-41-5 Summenformel: C9H10N2O2 Molekulargewicht (g/mol): 178.19 MDL-Nummer: MFCD08271948 InChI-Schlüssel: XKIFRVDOWHFUHG-UHFFFAOYSA-N Synonym: 5-2-furyl-1-methyl-1h-pyrazol-3-yl methanol,5-fur-2-yl-1-methyl-1h-pyrazol-3-yl methanol,5-furan-2-yl-1-methylpyrazol-3-yl methanol,5-furan-2-yl-1-methyl-1h-pyrazol-3-yl methanol,5-fur-2-yl-3-hydroxymethyl-1-methyl-1h-pyrazole,5-2-furyl-1-methylpyrazol-3-yl methan-1-ol,5-2-furyl-3-hydroxymethyl-1-methyl-1h-pyrazole PubChem CID: 18525802 IUPAC-Name: [5-(Furan-2-yl)-1-Methylpyrazol-3-yl]methanol SMILES: CN1N=C(CO)C=C1C1=CC=CO1

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Technische Daten

InChI-Schlüssel	XKIFRVDOWHFUHG-UHFFFAOYSA-N
IUPAC-Name	[5-(Furan-2-yl)-1-Methylpyrazol-3-yl]methanol
PubChem CID	18525802
CAS	876728-41-5
MDL-Nummer	MFCD08271948
Molekulargewicht (g/mol)	178.19
SMILES	CN1N=C(CO)C=C1C1=CC=CO1
Synonym	5-2-furyl-1-methyl-1h-pyrazol-3-yl methanol,5-fur-2-yl-1-methyl-1h-pyrazol-3-yl methanol,5-furan-2-yl-1-methylpyrazol-3-yl methanol,5-furan-2-yl-1-methyl-1h-pyrazol-3-yl methanol,5-fur-2-yl-3-hydroxymethyl-1-methyl-1h-pyrazole,5-2-furyl-1-methylpyrazol-3-yl methan-1-ol,5-2-furyl-3-hydroxymethyl-1-methyl-1h-pyrazole
Summenformel	C9H10N2O2

1H-Pyrazol, 98 %, Thermo Scientific Chemicals

CAS: 288-13-1 Summenformel: C3H4N2 Molekulargewicht (g/mol): 68.079 MDL-Nummer: MFCD00005234 InChI-Schlüssel: WTKZEGDFNFYCGP-UHFFFAOYSA-N Synonym: pyrazole,1,2-diazole,1h-pyrazol,pyrazol,unii-3qd5kjz7zj,3qd5kjz7zj,diazole,hpz,1-h-pyrazole,pyrazol#1 PubChem CID: 1048 ChEBI: CHEBI:17241 IUPAC-Name: 1H-Pyrazol SMILES: C1=CNN=C1

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Technische Daten

InChI-Schlüssel	WTKZEGDFNFYCGP-UHFFFAOYSA-N
IUPAC-Name	1H-Pyrazol
PubChem CID	1048
CAS	288-13-1
ChEBI	CHEBI:17241
MDL-Nummer	MFCD00005234
Molekulargewicht (g/mol)	68.079
SMILES	C1=CNN=C1
Synonym	pyrazole,1,2-diazole,1h-pyrazol,pyrazol,unii-3qd5kjz7zj,3qd5kjz7zj,diazole,hpz,1-h-pyrazole,pyrazol#1
Summenformel	C3H4N2

3-Amino-5-hydroxy-1H-pyrazol, 98 %, Thermo Scientific Chemicals

CAS: 6126-22-3 Summenformel: C3H5N3O Molekulargewicht (g/mol): 99.093 MDL-Nummer: MFCD00022384 InChI-Schlüssel: QZBGOTVBHYKUDS-UHFFFAOYSA-N Synonym: 3-amino-5-hydroxypyrazole,3-amino-1h-pyrazol-5-ol,5-amino-1h-pyrazol-3-ol,5-amino-1h-pyrazol-3 2h-one,3-amino-1,2-dihydropyrazol-5-one,5-aminopyrazol-3-ol,5-amino-2h-pyrazol-3-ol,3-pyrazolin-5-one, 3-amino,5-amino-2,3-dihydro-1h-pyrazol-3-one,1h-pyrazol-5-ol, 3-amino PubChem CID: 96221 IUPAC-Name: 5-Amino-1,2-Dihydropyrazol-3-on SMILES: C1=C(NNC1=O)N

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InChI-Schlüssel	QZBGOTVBHYKUDS-UHFFFAOYSA-N
IUPAC-Name	5-Amino-1,2-Dihydropyrazol-3-on
PubChem CID	96221
CAS	6126-22-3
MDL-Nummer	MFCD00022384
Molekulargewicht (g/mol)	99.093
SMILES	C1=C(NNC1=O)N
Synonym	3-amino-5-hydroxypyrazole,3-amino-1h-pyrazol-5-ol,5-amino-1h-pyrazol-3-ol,5-amino-1h-pyrazol-3 2h-one,3-amino-1,2-dihydropyrazol-5-one,5-aminopyrazol-3-ol,5-amino-2h-pyrazol-3-ol,3-pyrazolin-5-one, 3-amino,5-amino-2,3-dihydro-1h-pyrazol-3-one,1h-pyrazol-5-ol, 3-amino
Summenformel	C3H5N3O

Bendazac, Thermo Scientific Chemicals

CAS: 20187-55-7 Summenformel: C16H13N2NaO3 Molekulargewicht (g/mol): 304.28 InChI-Schlüssel: GHFGHIKJGVMEFT-UHFFFAOYSA-M IUPAC-Name: Natrium 2-[(1-Benzyl-1H-Indazol-3-yl)oxy]Acetat SMILES: [Na+].[O-]C(=O)COC1=NN(CC2=CC=CC=C2)C2=CC=CC=C12

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Technische Daten

InChI-Schlüssel	GHFGHIKJGVMEFT-UHFFFAOYSA-M
IUPAC-Name	Natrium 2-[(1-Benzyl-1H-Indazol-3-yl)oxy]Acetat
CAS	20187-55-7
Molekulargewicht (g/mol)	304.28
SMILES	[Na+].[O-]C(=O)COC1=NN(CC2=CC=CC=C2)C2=CC=CC=C12
Summenformel	C16H13N2NaO3

5-Amino-3-tert-butyl-1-methylpyrazol, 98 %, Thermo Scientific Chemicals

CAS: 118430-73-2 Summenformel: C8H15N3 Molekulargewicht (g/mol): 153.23 MDL-Nummer: MFCD00068002 InChI-Schlüssel: XSCDSAMVQLKDNI-UHFFFAOYSA-N Synonym: 5-amino-3-tert-butyl-1-methylpyrazole,3-tert-butyl-1-methyl-1h-pyrazol-5-amine,5-tert-butyl-2-methyl-2h-pyrazol-3-ylamine,1h-pyrazol-5-amine, 3-1,1-dimethylethyl-1-methyl,5-amino-3-tert-butyl-1-methyl-1h-pyrazole,3-tert-butyl-1-methylpyrazole-5-ylamine,acmc-1cins,maybridge4_002215,5-amino-1-methyl-3-tert-butylpyrazole PubChem CID: 2735287 SMILES: CN1N=C(C=C1N)C(C)(C)C

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Technische Daten

InChI-Schlüssel	XSCDSAMVQLKDNI-UHFFFAOYSA-N
PubChem CID	2735287
CAS	118430-73-2
MDL-Nummer	MFCD00068002
Molekulargewicht (g/mol)	153.23
SMILES	CN1N=C(C=C1N)C(C)(C)C
Synonym	5-amino-3-tert-butyl-1-methylpyrazole,3-tert-butyl-1-methyl-1h-pyrazol-5-amine,5-tert-butyl-2-methyl-2h-pyrazol-3-ylamine,1h-pyrazol-5-amine, 3-1,1-dimethylethyl-1-methyl,5-amino-3-tert-butyl-1-methyl-1h-pyrazole,3-tert-butyl-1-methylpyrazole-5-ylamine,acmc-1cins,maybridge4_002215,5-amino-1-methyl-3-tert-butylpyrazole
Summenformel	C8H15N3

(1,5-Dimethyl-1H-pyrazol-3-yl)-methanol, 97 %, Thermo Scientific™

CAS: 153912-60-8 Summenformel: C6H10N2O Molekulargewicht (g/mol): 126.159 MDL-Nummer: MFCD03659702 InChI-Schlüssel: XJBMHIHXRARJJS-UHFFFAOYSA-N Synonym: 1,5-dimethyl-1h-pyrazol-3-yl methanol,1,5-dimethyl-1h-pyrazol-3-yl-methanol,1,5-dimethylpyrazol-3-yl methanol,3-hydroxymethyl-1,5-dimethyl-1h-pyrazole,1h-pyrazole-3-methanol,1,5-dimethyl,1,5-dimethyl-3-hydroxymethyl-1h-pyrazole,1,5-dimethyl-3-hydroxymethyl pyrazole,akos pao-0060,acmc-1cisl,1,5-dimethylpyrazole-3-methanol PubChem CID: 2776366 IUPAC-Name: (1,5-Dimethylpyrazol-3-yl)methanol SMILES: CC1=CC(=NN1C)CO

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InChI-Schlüssel	XJBMHIHXRARJJS-UHFFFAOYSA-N
IUPAC-Name	(1,5-Dimethylpyrazol-3-yl)methanol
PubChem CID	2776366
CAS	153912-60-8
MDL-Nummer	MFCD03659702
Molekulargewicht (g/mol)	126.159
SMILES	CC1=CC(=NN1C)CO
Synonym	1,5-dimethyl-1h-pyrazol-3-yl methanol,1,5-dimethyl-1h-pyrazol-3-yl-methanol,1,5-dimethylpyrazol-3-yl methanol,3-hydroxymethyl-1,5-dimethyl-1h-pyrazole,1h-pyrazole-3-methanol,1,5-dimethyl,1,5-dimethyl-3-hydroxymethyl-1h-pyrazole,1,5-dimethyl-3-hydroxymethyl pyrazole,akos pao-0060,acmc-1cisl,1,5-dimethylpyrazole-3-methanol
Summenformel	C6H10N2O

4-(1H-Pyrazol-1-ylmethyl)benzonitril, ≥97 %, Thermo Scientific™

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4-(1 H-Pyrazol-1-ylmethyl)anilin, 95 %, Thermo Scientific™

CAS: 142335-61-3 Summenformel: C10H11N3 Molekulargewicht (g/mol): 173.22 MDL-Nummer: MFCD03422514 InChI-Schlüssel: ISRYTHBRUSOVAB-UHFFFAOYSA-N Synonym: 4-1h-pyrazol-1-ylmethyl aniline,4-1h-pyrazol-1-yl methyl aniline,4-pyrazol-1-ylmethyl aniline,4-1-pyrazolyl methyl aniline,4-pyrazol-1-ylmethyl-phenylamine,4-pyrazol-1-ylmethylphenylamine,benzenamine,4-1h-pyrazol-1-ylmethyl,4-pyrazolylmethyl phenylamine,pyrazolylmethylaniline PubChem CID: 2764412 IUPAC-Name: 4-(Pyrazol-1-ylmethyl)Anilin SMILES: NC1=CC=C(CN2C=CC=N2)C=C1

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InChI-Schlüssel	ISRYTHBRUSOVAB-UHFFFAOYSA-N
IUPAC-Name	4-(Pyrazol-1-ylmethyl)Anilin
PubChem CID	2764412
CAS	142335-61-3
MDL-Nummer	MFCD03422514
Molekulargewicht (g/mol)	173.22
SMILES	NC1=CC=C(CN2C=CC=N2)C=C1
Synonym	4-1h-pyrazol-1-ylmethyl aniline,4-1h-pyrazol-1-yl methyl aniline,4-pyrazol-1-ylmethyl aniline,4-1-pyrazolyl methyl aniline,4-pyrazol-1-ylmethyl-phenylamine,4-pyrazol-1-ylmethylphenylamine,benzenamine,4-1h-pyrazol-1-ylmethyl,4-pyrazolylmethyl phenylamine,pyrazolylmethylaniline
Summenformel	C10H11N3

(1,3-Dimethyl-1H-pyrazol-5-yl)-methanol, 97 %, Thermo Scientific™

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[5-(2-Furyl)-1H-pyrazol-3-yl]methano, 97 %, Thermo Scientific™

CAS: 84978-67-6 Summenformel: C8H8N2O2 Molekulargewicht (g/mol): 164.164 InChI-Schlüssel: NBADTAIDQSLLHA-UHFFFAOYSA-N Synonym: 5-2-furyl-1h-pyrazol-3-yl methanol,5-furan-2-yl-1h-pyrazol-3-yl methanol,3-furan-2-yl-1h-pyrazol-5-yl methanol,5-2-furyl pyrazol-3-yl methan-1-ol,1h-pyrazole-3-methanol,5-2-furanyl,5-2-furyl-1h-pyrazol-4-yl methanol,5-fur-2-yl-1h-pyrazol-3-yl methanol,5-furan-2-yl-2h-pyrazol-3-yl methanol PubChem CID: 7060534 IUPAC-Name: [3-(Furan-2-yl)-1H-pyrazol-5-yl]methanol SMILES: C1=COC(=C1)C2=NNC(=C2)CO

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Technische Daten

InChI-Schlüssel	NBADTAIDQSLLHA-UHFFFAOYSA-N
IUPAC-Name	[3-(Furan-2-yl)-1H-pyrazol-5-yl]methanol
PubChem CID	7060534
CAS	84978-67-6
Molekulargewicht (g/mol)	164.164
SMILES	C1=COC(=C1)C2=NNC(=C2)CO
Synonym	5-2-furyl-1h-pyrazol-3-yl methanol,5-furan-2-yl-1h-pyrazol-3-yl methanol,3-furan-2-yl-1h-pyrazol-5-yl methanol,5-2-furyl pyrazol-3-yl methan-1-ol,1h-pyrazole-3-methanol,5-2-furanyl,5-2-furyl-1h-pyrazol-4-yl methanol,5-fur-2-yl-1h-pyrazol-3-yl methanol,5-furan-2-yl-2h-pyrazol-3-yl methanol
Summenformel	C8H8N2O2

(1-Methyl-1H-pyrazol-5-yl)-methanol, 97 %, Acros Organics™

CAS: 84547-61-5 Summenformel: C5H8N2O Molekulargewicht (g/mol): 112.132 MDL-Nummer: MFCD08556301 InChI-Schlüssel: WQFOGLYQVFBDEY-UHFFFAOYSA-N Synonym: 1-methyl-1h-pyrazol-5-yl methanol,5-hydroxymethyl-1-methyl-1h-pyrazole,1h-pyrazole-5-methanol, 1-methyl,2-methylpyrazol-3-yl methanol,5-hydroxymethyl-1-methylpyrazole,1h-pyrazole-5-methanol,1-methyl,1-methylpyrazol-5-yl methan-1-ol,1-methylpyrazole-5-methanol,1-methyl-1h-pyrazol-5-yl ;methanol PubChem CID: 11815316 IUPAC-Name: (2-Methylpyrazol-3-yl)methanol SMILES: CN1C(=CC=N1)CO

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Technische Daten

InChI-Schlüssel	WQFOGLYQVFBDEY-UHFFFAOYSA-N
IUPAC-Name	(2-Methylpyrazol-3-yl)methanol
PubChem CID	11815316
CAS	84547-61-5
MDL-Nummer	MFCD08556301
Molekulargewicht (g/mol)	112.132
SMILES	CN1C(=CC=N1)CO
Synonym	1-methyl-1h-pyrazol-5-yl methanol,5-hydroxymethyl-1-methyl-1h-pyrazole,1h-pyrazole-5-methanol, 1-methyl,2-methylpyrazol-3-yl methanol,5-hydroxymethyl-1-methylpyrazole,1h-pyrazole-5-methanol,1-methyl,1-methylpyrazol-5-yl methan-1-ol,1-methylpyrazole-5-methanol,1-methyl-1h-pyrazol-5-yl ;methanol
Summenformel	C5H8N2O

Pyrazole

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