Pyrazoles

Organic heterocyclic compounds that consists of a 5-membered ring of three carbon atoms and two adjacent nitrogen atoms with the formula: C₃H₃N₂H.

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6-Iodo-1H-indazole, 97%, Thermo Scientific™

CAS: 261953-36-0 Molecular Formula: C₇H₅IN₂ Molecular Weight (g/mol): 244.03 MDL Number: MFCD04114695 InChI Key: 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-iodo-1H-indazole SMILES: C1=CC2=C(C=C1I)NN=C2

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Specifications

PubChem CID	12991241
CAS	261953-36-0
Molecular Weight (g/mol)	244.03
MDL Number	MFCD04114695
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
IUPAC Name	6-iodo-1H-indazole
InChI Key	RSGAXJZKQDNFEP-UHFFFAOYSA-N
Molecular Formula	C₇H₅IN₂

Thermo Scientific Chemicals Allopurinol, 98%

CAS: 315-30-0 Molecular Formula: C5H4N4O Molecular Weight (g/mol): 136.11 MDL Number: MFCD00599413 InChI Key: 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-dihydropyrazolo[3,4-d]pyrimidin-4-one SMILES: O=C1N=CN=C2NNC=C12

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Specifications

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

7-Nitro-1H-indazole, 98%

CAS: 2942-42-9 Molecular Formula: C7H5N3O2 Molecular Weight (g/mol): 163.136 MDL Number: MFCD00022789 InChI Key: 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-indazole SMILES: C1=CC2=C(C(=C1)[N+](=O)[O-])NN=C2

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Specifications

PubChem CID	1893
CAS	2942-42-9
Molecular Weight (g/mol)	163.136
MDL Number	MFCD00022789
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
IUPAC Name	7-nitro-1H-indazole
InChI Key	PQCAUHUKTBHUSA-UHFFFAOYSA-N
Molecular Formula	C7H5N3O2

Pyrazole, 98%, pure

CAS: 288-13-1 Molecular Formula: C₃H₄N₂ Molecular Weight (g/mol): 68.08 MDL Number: MFCD00005234 InChI Key: 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-pyrazole SMILES: C1=CNN=C1

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Specifications

PubChem CID	1048
CAS	288-13-1
Molecular Weight (g/mol)	68.08
ChEBI	CHEBI:17241
MDL Number	MFCD00005234
SMILES	C1=CNN=C1
Synonym	pyrazole,1,2-diazole,1h-pyrazol,pyrazol,unii-3qd5kjz7zj,3qd5kjz7zj,diazole,hpz,1-h-pyrazole,pyrazol#1
IUPAC Name	1H-pyrazole
InChI Key	WTKZEGDFNFYCGP-UHFFFAOYSA-N
Molecular Formula	C₃H₄N₂

Indazole, 96%

CAS: 271-44-3 Molecular Formula: C₇H₆N₂ Molecular Weight (g/mol): 118.14 InChI Key: BAXOFTOLAUCFNW-UHFFFAOYSA-N Synonym: indazole,1h-benzopyrazole,2-azaindole,isoindazole,2h-indazole,1,2-diazaindene,1,2-benzodiazole,1h-indazol,benzopyrazole,1,2-benzopyrazole PubChem CID: 9221 ChEBI: CHEBI:36669 IUPAC Name: 1H-indazole SMILES: C1=CC=C2C(=C1)C=NN2

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Specifications

PubChem CID	9221
CAS	271-44-3
Molecular Weight (g/mol)	118.14
ChEBI	CHEBI:36669
SMILES	C1=CC=C2C(=C1)C=NN2
Synonym	indazole,1h-benzopyrazole,2-azaindole,isoindazole,2h-indazole,1,2-diazaindene,1,2-benzodiazole,1h-indazol,benzopyrazole,1,2-benzopyrazole
IUPAC Name	1H-indazole
InChI Key	BAXOFTOLAUCFNW-UHFFFAOYSA-N
Molecular Formula	C₇H₆N₂

1:3-Dimethyl-1H-pyrazole-5-carbothioamide, 97%, Thermo Scientific™

CAS: 844891-03-8 Molecular Formula: C6H9N3S Molecular Weight (g/mol): 155.219 InChI Key: RVWYPAZKPYVUDC-UHFFFAOYSA-N Synonym: 1,3-dimethyl-1h-pyrazole-5-carbothioamide,1h-pyrazole-5-carbothioamide,1,3-dimethyl,amino 1,3-dimethylpyrazol-5-yl methane-1-thione PubChem CID: 2795270 IUPAC Name: 2,5-dimethylpyrazole-3-carbothioamide SMILES: CC1=NN(C(=C1)C(=S)N)C

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Specifications

PubChem CID	2795270
CAS	844891-03-8
Molecular Weight (g/mol)	155.219
SMILES	CC1=NN(C(=C1)C(=S)N)C
Synonym	1,3-dimethyl-1h-pyrazole-5-carbothioamide,1h-pyrazole-5-carbothioamide,1,3-dimethyl,amino 1,3-dimethylpyrazol-5-yl methane-1-thione
IUPAC Name	2,5-dimethylpyrazole-3-carbothioamide
InChI Key	RVWYPAZKPYVUDC-UHFFFAOYSA-N
Molecular Formula	C6H9N3S

4-Methyl-1H-pyrazole, 97+%

CAS: 7554-65-6 Molecular Formula: C4H6N2 Molecular Weight (g/mol): 82.106 MDL Number: MFCD00005245 InChI Key: RIKMMFOAQPJVMX-UHFFFAOYSA-N Synonym: 4-methylpyrazole,fomepizole,antizol,1h-pyrazole, 4-methyl,fomepizol,4-methylpyrazol,fomepizolum,fomepizol inn-spanish,fomepizolum inn-latin,fomepizole usan:inn PubChem CID: 3406 ChEBI: CHEBI:5141 IUPAC Name: 4-methyl-1H-pyrazole SMILES: CC1=CNN=C1

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Specifications

PubChem CID	3406
CAS	7554-65-6
Molecular Weight (g/mol)	82.106
ChEBI	CHEBI:5141
MDL Number	MFCD00005245
SMILES	CC1=CNN=C1
Synonym	4-methylpyrazole,fomepizole,antizol,1h-pyrazole, 4-methyl,fomepizol,4-methylpyrazol,fomepizolum,fomepizol inn-spanish,fomepizolum inn-latin,fomepizole usan:inn
IUPAC Name	4-methyl-1H-pyrazole
InChI Key	RIKMMFOAQPJVMX-UHFFFAOYSA-N
Molecular Formula	C4H6N2

5-BOC-1,4,6,7-tetrahydropyrazolo[4,3-c]pyridine, 97%, Thermo Scientific™

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1-Methyl-1H-pyrazole-5-sulfonyl chloride, 97%, Thermo Scientific™

CAS: 1020721-61-2 Molecular Formula: C4H5ClN2O2S Molecular Weight (g/mol): 180.606 MDL Number: MFCD09065021 InChI Key: OWLKLUGPVSESBX-UHFFFAOYSA-N Synonym: 1-methyl-1h-pyrazole-5-sulfonyl chloride,2-methyl-2h-pyrazole-3-sulfonyl chloride,5-chlorosulphonyl-1-methyl-1h-pyrazole,chloro 1-methylpyrazol-5-yl sulfone,1-methyl-1h-pyrazole-5-sulphonyl chloride,2-methylpyrazol-3-yl methanesulfonyl chloride PubChem CID: 22472621 IUPAC Name: 2-methylpyrazole-3-sulfonyl chloride SMILES: CN1C(=CC=N1)S(=O)(=O)Cl

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Specifications

PubChem CID	22472621
CAS	1020721-61-2
Molecular Weight (g/mol)	180.606
MDL Number	MFCD09065021
SMILES	CN1C(=CC=N1)S(=O)(=O)Cl
Synonym	1-methyl-1h-pyrazole-5-sulfonyl chloride,2-methyl-2h-pyrazole-3-sulfonyl chloride,5-chlorosulphonyl-1-methyl-1h-pyrazole,chloro 1-methylpyrazol-5-yl sulfone,1-methyl-1h-pyrazole-5-sulphonyl chloride,2-methylpyrazol-3-yl methanesulfonyl chloride
IUPAC Name	2-methylpyrazole-3-sulfonyl chloride
InChI Key	OWLKLUGPVSESBX-UHFFFAOYSA-N
Molecular Formula	C4H5ClN2O2S

2-Acetyl-5-iodo-2H-indazole, 95%, Thermo Scientific™

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4-Trifluoromethyl-1H-pyrazole, 97%

CAS: 52222-73-8 Molecular Formula: C4H3F3N2 Molecular Weight (g/mol): 136.077 MDL Number: MFCD11226572 InChI Key: KDEJQUNODYXYBJ-UHFFFAOYSA-N Synonym: 4-trifluoromethyl-1h-pyrazole,1h-pyrazole, 4-trifluoromethyl,4-trifluoromethylpyrazole,4-trifluoromethyl pyrazole,4-trifluoromethyl-1 h-pyrazole,4-trifluoromethyl ;-1h-pyrazole PubChem CID: 12777795 IUPAC Name: 4-(trifluoromethyl)-1H-pyrazole SMILES: C1=C(C=NN1)C(F)(F)F

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Specifications

PubChem CID	12777795
CAS	52222-73-8
Molecular Weight (g/mol)	136.077
MDL Number	MFCD11226572
SMILES	C1=C(C=NN1)C(F)(F)F
Synonym	4-trifluoromethyl-1h-pyrazole,1h-pyrazole, 4-trifluoromethyl,4-trifluoromethylpyrazole,4-trifluoromethyl pyrazole,4-trifluoromethyl-1 h-pyrazole,4-trifluoromethyl ;-1h-pyrazole
IUPAC Name	4-(trifluoromethyl)-1H-pyrazole
InChI Key	KDEJQUNODYXYBJ-UHFFFAOYSA-N
Molecular Formula	C4H3F3N2

Methyl 1H-indazole-6-carboxylate, 95%, Thermo Scientific™

CAS: 170487-40-8 Molecular Formula: C9H8N2O2 Molecular Weight (g/mol): 176.175 MDL Number: MFCD07371612 InChI Key: TUSICEWIXLMXEY-UHFFFAOYSA-N Synonym: 1h-indazole-6-carboxylic acid methyl ester,methyl indazole-6-carboxylate,indazole-6-carboxylic acid methyl ester,6-1h indazole carboxylic acid methyl ester,1h-indazole-6-carboxylic acid, methyl ester,pubchem18064,methyl indazole-6carboxylate,ksc494o4p,methyl-1h-indazole-6-carboxylate,2h-indazole-6-carboxylic acid methyl ester PubChem CID: 286535 IUPAC Name: methyl 1H-indazole-6-carboxylate SMILES: COC(=O)C1=CC2=C(C=C1)C=NN2

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Specifications

PubChem CID	286535
CAS	170487-40-8
Molecular Weight (g/mol)	176.175
MDL Number	MFCD07371612
SMILES	COC(=O)C1=CC2=C(C=C1)C=NN2
Synonym	1h-indazole-6-carboxylic acid methyl ester,methyl indazole-6-carboxylate,indazole-6-carboxylic acid methyl ester,6-1h indazole carboxylic acid methyl ester,1h-indazole-6-carboxylic acid, methyl ester,pubchem18064,methyl indazole-6carboxylate,ksc494o4p,methyl-1h-indazole-6-carboxylate,2h-indazole-6-carboxylic acid methyl ester
IUPAC Name	methyl 1H-indazole-6-carboxylate
InChI Key	TUSICEWIXLMXEY-UHFFFAOYSA-N
Molecular Formula	C9H8N2O2

2-(1H-Pyrazol-3-yl)pyridine, 98%

CAS: 75415-03-1 Molecular Formula: C8H7N3 Molecular Weight (g/mol): 145.17 MDL Number: MFCD00115151 InChI Key: HKEWOTUTAYJWQJ-UHFFFAOYSA-N Synonym: 2-1h-pyrazol-3-yl pyridine,2-1h-pyrazol-5-yl pyridine,2-pyrazol-3-yl-pyridine,2-1h-pyrazol-3-yl-pyridine,2-3-pyrazolyl pyridine,pyridine, 2-1h-pyrazol-3-yl,3-2-pyridyl pyrazole,2-2h-pyrazol-3-yl pyridine,2-3e-pyrazol-3-ylidene-1h-pyridine,pyrazolylpyridine PubChem CID: 2797657 IUPAC Name: 2-(1H-pyrazol-5-yl)pyridine SMILES: N1N=CC=C1C1=CC=CC=N1

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Specifications

PubChem CID	2797657
CAS	75415-03-1
Molecular Weight (g/mol)	145.17
MDL Number	MFCD00115151
SMILES	N1N=CC=C1C1=CC=CC=N1
Synonym	2-1h-pyrazol-3-yl pyridine,2-1h-pyrazol-5-yl pyridine,2-pyrazol-3-yl-pyridine,2-1h-pyrazol-3-yl-pyridine,2-3-pyrazolyl pyridine,pyridine, 2-1h-pyrazol-3-yl,3-2-pyridyl pyrazole,2-2h-pyrazol-3-yl pyridine,2-3e-pyrazol-3-ylidene-1h-pyridine,pyrazolylpyridine
IUPAC Name	2-(1H-pyrazol-5-yl)pyridine
InChI Key	HKEWOTUTAYJWQJ-UHFFFAOYSA-N
Molecular Formula	C8H7N3

1-Methyl-5-phenoxy-3-(trifluoromethyl)-1H-pyrazole-4-carbaldehyde, 97%, Thermo Scientific™

CAS: 109925-42-0 Molecular Formula: C12H9F3N2O2 Molecular Weight (g/mol): 270.211 MDL Number: MFCD01936001 InChI Key: JDLPKSIFGPLXAU-UHFFFAOYSA-N Synonym: 1-methyl-5-phenoxy-3-trifluoromethyl-1h-pyrazole-4-carbaldehyde,1-methyl-5-phenoxy-3-trifluoromethyl pyrazole-4-carbaldehyde,1-methyl-5-phenoxy-3-trifluoromethyl-1h-pyrazole-4-carboxaldehyde,1h-pyrazole-4-carboxaldehyde,1-methyl-5-phenoxy-3-trifluoromethyl,acmc-20a3tk,methylphenoxytrifluoromethylpyrazolecarbaldehyde,1-methyl-5-phenoxy-3-trifluoromethyl-1h-pyrazole-4-carboxyaldehyde PubChem CID: 2775493 IUPAC Name: 1-methyl-5-phenoxy-3-(trifluoromethyl)pyrazole-4-carbaldehyde SMILES: CN1C(=C(C(=N1)C(F)(F)F)C=O)OC2=CC=CC=C2

Pricing and Availability
Specifications

PubChem CID	2775493
CAS	109925-42-0
Molecular Weight (g/mol)	270.211
MDL Number	MFCD01936001
SMILES	CN1C(=C(C(=N1)C(F)(F)F)C=O)OC2=CC=CC=C2
Synonym	1-methyl-5-phenoxy-3-trifluoromethyl-1h-pyrazole-4-carbaldehyde,1-methyl-5-phenoxy-3-trifluoromethyl pyrazole-4-carbaldehyde,1-methyl-5-phenoxy-3-trifluoromethyl-1h-pyrazole-4-carboxaldehyde,1h-pyrazole-4-carboxaldehyde,1-methyl-5-phenoxy-3-trifluoromethyl,acmc-20a3tk,methylphenoxytrifluoromethylpyrazolecarbaldehyde,1-methyl-5-phenoxy-3-trifluoromethyl-1h-pyrazole-4-carboxyaldehyde
IUPAC Name	1-methyl-5-phenoxy-3-(trifluoromethyl)pyrazole-4-carbaldehyde
InChI Key	JDLPKSIFGPLXAU-UHFFFAOYSA-N
Molecular Formula	C12H9F3N2O2

1H-Indazole, 99%

CAS: 271-44-3 Molecular Formula: C7H6N2 Molecular Weight (g/mol): 118.139 MDL Number: MFCD00005691 InChI Key: BAXOFTOLAUCFNW-UHFFFAOYSA-N Synonym: indazole,1h-benzopyrazole,2-azaindole,isoindazole,2h-indazole,1,2-diazaindene,1,2-benzodiazole,1h-indazol,benzopyrazole,1,2-benzopyrazole PubChem CID: 9221 ChEBI: CHEBI:36669 IUPAC Name: 1H-indazole SMILES: C1=CC=C2C(=C1)C=NN2

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Specifications

PubChem CID	9221
CAS	271-44-3
Molecular Weight (g/mol)	118.139
ChEBI	CHEBI:36669
MDL Number	MFCD00005691
SMILES	C1=CC=C2C(=C1)C=NN2
Synonym	indazole,1h-benzopyrazole,2-azaindole,isoindazole,2h-indazole,1,2-diazaindene,1,2-benzodiazole,1h-indazol,benzopyrazole,1,2-benzopyrazole
IUPAC Name	1H-indazole
InChI Key	BAXOFTOLAUCFNW-UHFFFAOYSA-N
Molecular Formula	C7H6N2

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