Pyrazoles

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

1 – 15 de 127 résultats

5-Fluoro-1H-indazole, 98%

CAS: 348-26-5 Formule moléculaire: C7H5FN2 Poids moléculaire (g/mol): 136.129 Numéro MDL: MFCD04972877 Clé InChI: LIWIWTHSKJBYDW-UHFFFAOYSA-N Synonyme: 5-fluoroindazole,5-fluoro-2h-indazole,1h-indazole, 5-fluoro,chembl16076,5-fluoranyl-1h-indazole,2h-indazole, 5-fluoro,acmc-209zy1,indazole, 5-fluoro,5-fluoro-1h-indazole CID PubChem: 17842486 Nom IUPAC: 5-fluoro-1H-indazole SMILES: C1=CC2=C(C=C1F)C=NN2

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Poids moléculaire (g/mol)	136.129
Synonyme	5-fluoroindazole,5-fluoro-2h-indazole,1h-indazole, 5-fluoro,chembl16076,5-fluoranyl-1h-indazole,2h-indazole, 5-fluoro,acmc-209zy1,indazole, 5-fluoro,5-fluoro-1h-indazole
Numéro MDL	MFCD04972877
CAS	348-26-5
CID PubChem	17842486
Nom IUPAC	5-fluoro-1H-indazole
Clé InChI	LIWIWTHSKJBYDW-UHFFFAOYSA-N
SMILES	C1=CC2=C(C=C1F)C=NN2
Formule moléculaire	C7H5FN2

1H-Pyrazole-3-boronic acid hydrate, 95%

CAS: 376584-63-3 Formule moléculaire: C3H5BN2O2 Poids moléculaire (g/mol): 111.90 Numéro MDL: MFCD07368247 MFCD02020768 Clé InChI: NEUWPDLMDVINSN-UHFFFAOYSA-N Synonyme: 1h-pyrazol-3-yl boronic acid,pyrazole-3-boronic acid,1h-pyrazol-3-ylboronic acid,1h-pyrazole-3-boronic acid,1h-pyrazole-5-boronic acid,1h-pyrazol-5-yl boronic acid,1h-pyrazol-5-yl-5-boronic acid,pyrazol-3-ylboronic acid,2h-pyrazol-3-ylboronic acid CID PubChem: 11251979 Nom IUPAC: 1H-pyrazol-5-ylboronic acid SMILES: OB(O)C1=NNC=C1

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Poids moléculaire (g/mol)	111.90
Synonyme	1h-pyrazol-3-yl boronic acid,pyrazole-3-boronic acid,1h-pyrazol-3-ylboronic acid,1h-pyrazole-3-boronic acid,1h-pyrazole-5-boronic acid,1h-pyrazol-5-yl boronic acid,1h-pyrazol-5-yl-5-boronic acid,pyrazol-3-ylboronic acid,2h-pyrazol-3-ylboronic acid
Numéro MDL	MFCD07368247 MFCD02020768
CAS	376584-63-3
CID PubChem	11251979
Nom IUPAC	1H-pyrazol-5-ylboronic acid
Clé InChI	NEUWPDLMDVINSN-UHFFFAOYSA-N
SMILES	OB(O)C1=NNC=C1
Formule moléculaire	C3H5BN2O2

N-Boc-1H-pyrazole-1-carboxamidine, 98+%

CAS: 152120-61-1 Formule moléculaire: C9H14N4O2 Poids moléculaire (g/mol): 210.237 Numéro MDL: MFCD00216663 Clé InChI: IGSFMHYSWZUENI-UHFFFAOYSA-N Synonyme: n-boc-1-guanylpyrazole,n-boc-1h-pyrazole-1-carboxamidine,n-boc-pyrazole-1-carboxamidine,n-tert-butoxycarbonyl-1h-pyrazole-1-carboxamidine,tert-butyl 1e-amino 1h-pyrazol-1-yl methylene carbamate,n-tert-butoxycarbonyl-1 h-pyrazole-1-carboxamidine,h-pyrazole-1-carboxamidine hcl,1h-pyrazole-n-t-butyloxycarbonyl-1-carboxamidine,tert-butoxy-n-iminopyrazolylmethyl carboxamide,tert-butyl imino 1h-pyrazol-1-yl methylcarbamate CID PubChem: 9605068 Nom IUPAC: tert-butyl (NE)-N-[amino(pyrazol-1-yl)methylidene]carbamate SMILES: CC(C)(C)OC(=O)N=C(N)N1C=CC=N1

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Poids moléculaire (g/mol)	210.237
Synonyme	n-boc-1-guanylpyrazole,n-boc-1h-pyrazole-1-carboxamidine,n-boc-pyrazole-1-carboxamidine,n-tert-butoxycarbonyl-1h-pyrazole-1-carboxamidine,tert-butyl 1e-amino 1h-pyrazol-1-yl methylene carbamate,n-tert-butoxycarbonyl-1 h-pyrazole-1-carboxamidine,h-pyrazole-1-carboxamidine hcl,1h-pyrazole-n-t-butyloxycarbonyl-1-carboxamidine,tert-butoxy-n-iminopyrazolylmethyl carboxamide,tert-butyl imino 1h-pyrazol-1-yl methylcarbamate
Numéro MDL	MFCD00216663
CAS	152120-61-1
CID PubChem	9605068
Nom IUPAC	tert-butyl (NE)-N-[amino(pyrazol-1-yl)methylidene]carbamate
Clé InChI	IGSFMHYSWZUENI-UHFFFAOYSA-N
SMILES	CC(C)(C)OC(=O)N=C(N)N1C=CC=N1
Formule moléculaire	C9H14N4O2

Potassium tris(3,5-dimethyl-1-pyrazolyl)borohydride, 99%

CAS: 17567-17-8 Formule moléculaire: C15H22BKN6 Poids moléculaire (g/mol): 336.29 Numéro MDL: MFCD00040342 Clé InChI: NTWZGFNSHCFHIJ-UHFFFAOYSA-N Synonyme: potassium hydrotris 3,5-dimethylpyrazol-1-yl borate,potassium;tris 3,5-dimethylpyrazol-1-yl boron 1-,potassium tri 3,5-dimethyl-1-pyrazolyl borohydride,potassium tris 3,5-dimethyl-1h-pyrazol-1-yl hydrido borate 1- Nom IUPAC: potassium tris(3,5-dimethyl-1H-pyrazol-1-yl)boranuide SMILES: [K+].CC1=NN([BH-](N2N=C(C)C=C2C)N2N=C(C)C=C2C)C(C)=C1

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Poids moléculaire (g/mol)	336.29
Synonyme	potassium hydrotris 3,5-dimethylpyrazol-1-yl borate,potassium;tris 3,5-dimethylpyrazol-1-yl boron 1-,potassium tri 3,5-dimethyl-1-pyrazolyl borohydride,potassium tris 3,5-dimethyl-1h-pyrazol-1-yl hydrido borate 1-
Numéro MDL	MFCD00040342
CAS	17567-17-8
Nom IUPAC	potassium tris(3,5-dimethyl-1H-pyrazol-1-yl)boranuide
Clé InChI	NTWZGFNSHCFHIJ-UHFFFAOYSA-N
SMILES	[K+].CC1=NN([BH-](N2N=C(C)C=C2C)N2N=C(C)C=C2C)C(C)=C1
Formule moléculaire	C15H22BKN6

Bendazac, Thermo Scientific™

Formule moléculaire: C16H13N2NaO3 Poids moléculaire (g/mol): 304.28 Clé InChI: GHFGHIKJGVMEFT-UHFFFAOYSA-M Nom IUPAC: sodium 2-[(1-benzyl-1H-indazol-3-yl)oxy]acetate SMILES: [Na+].[O-]C(=O)COC1=NN(CC2=CC=CC=C2)C2=CC=CC=C12

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Poids moléculaire (g/mol)	304.28
Nom IUPAC	sodium 2-[(1-benzyl-1H-indazol-3-yl)oxy]acetate
Clé InChI	GHFGHIKJGVMEFT-UHFFFAOYSA-M
SMILES	[Na+].[O-]C(=O)COC1=NN(CC2=CC=CC=C2)C2=CC=CC=C12
Formule moléculaire	C16H13N2NaO3

1H-Indazole-6-carboxylic acid, 97%

CAS: 704-91-6 Formule moléculaire: C8H6N2O2 Poids moléculaire (g/mol): 162.15 Numéro MDL: MFCD06804571 Clé InChI: DNCVTVVLMRHJCJ-UHFFFAOYSA-N Synonyme: indazole-6-carboxylic acid,1h-indazole-6-carboxylicacid,6-carboxyindazole,6-carboxy-1h-indazole,6-indazolecarboxylic acid,ksc376q7p,1h-indazole-6-carboxylic acid,6-1h indazole carboxylic acid CID PubChem: 16227938 Nom IUPAC: 1H-indazole-6-carboxylic acid SMILES: OC(=O)C1=CC=C2C=NNC2=C1

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Poids moléculaire (g/mol)	162.15
Synonyme	indazole-6-carboxylic acid,1h-indazole-6-carboxylicacid,6-carboxyindazole,6-carboxy-1h-indazole,6-indazolecarboxylic acid,ksc376q7p,1h-indazole-6-carboxylic acid,6-1h indazole carboxylic acid
Numéro MDL	MFCD06804571
CAS	704-91-6
CID PubChem	16227938
Nom IUPAC	1H-indazole-6-carboxylic acid
Clé InChI	DNCVTVVLMRHJCJ-UHFFFAOYSA-N
SMILES	OC(=O)C1=CC=C2C=NNC2=C1
Formule moléculaire	C8H6N2O2

3-Amino-1-methyl-1H-indazole, 95%

CAS: 60301-20-4 Formule moléculaire: C8H9N3 Poids moléculaire (g/mol): 147.18 Numéro MDL: MFCD09054755 Clé InChI: NYLGITXFVVEBLZ-UHFFFAOYSA-N Synonyme: 1-methyl-1h-indazol-3-amine,3-amino-1-methylindazole,3-amino-1-methyl-1h-indazole,1h-indazol-3-amine, 1-methyl,n-methyl-3-aminoindazole,1-methyl-1h-3-indazoleamine,1-methyl-1h-indazole-3-amine,1-methyl-1h-indazol-3-ylamine,1-methyl-1h-indazole-3-ylamine CID PubChem: 12291317 SMILES: CN1N=C(N)C2=CC=CC=C12

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Poids moléculaire (g/mol)	147.18
Synonyme	1-methyl-1h-indazol-3-amine,3-amino-1-methylindazole,3-amino-1-methyl-1h-indazole,1h-indazol-3-amine, 1-methyl,n-methyl-3-aminoindazole,1-methyl-1h-3-indazoleamine,1-methyl-1h-indazole-3-amine,1-methyl-1h-indazol-3-ylamine,1-methyl-1h-indazole-3-ylamine
Numéro MDL	MFCD09054755
CAS	60301-20-4
CID PubChem	12291317
Clé InChI	NYLGITXFVVEBLZ-UHFFFAOYSA-N
SMILES	CN1N=C(N)C2=CC=CC=C12
Formule moléculaire	C8H9N3

4-Methylpyrazole, 97%

CAS: 7554-65-6 Formule moléculaire: C₄H₆N₂ Poids moléculaire (g/mol): 82.11 Clé InChI: RIKMMFOAQPJVMX-UHFFFAOYSA-N Synonyme: 4-methylpyrazole,fomepizole,antizol,1h-pyrazole, 4-methyl,fomepizol,4-methylpyrazol,fomepizolum,fomepizol inn-spanish,fomepizolum inn-latin,fomepizole usan:inn CID PubChem: 3406 ChEBI: CHEBI:5141 Nom IUPAC: 4-methyl-1H-pyrazole SMILES: CC1=CNN=C1

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Poids moléculaire (g/mol)	82.11
Synonyme	4-methylpyrazole,fomepizole,antizol,1h-pyrazole, 4-methyl,fomepizol,4-methylpyrazol,fomepizolum,fomepizol inn-spanish,fomepizolum inn-latin,fomepizole usan:inn
CAS	7554-65-6
CID PubChem	3406
ChEBI	CHEBI:5141
Nom IUPAC	4-methyl-1H-pyrazole
Clé InChI	RIKMMFOAQPJVMX-UHFFFAOYSA-N
SMILES	CC1=CNN=C1
Formule moléculaire	C₄H₆N₂

4-Hydroxy-1H-pyrazolo[3,4-d]pyrimidine, 98%

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

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

1-Cyanoacetyl-3,5-dimethyl-1H-pyrazole, 97%

CAS: 36140-83-7 Formule moléculaire: C8H9N3O Poids moléculaire (g/mol): 163.18 Numéro MDL: MFCD00051954 Clé InChI: DDWZYWSLHBDVGR-UHFFFAOYSA-N Synonyme: 1-cyanoacetyl-3,5-dimethylpyrazole,3-3,5-dimethyl-1h-pyrazol-1-yl-3-oxopropanenitrile,3-3,5-dimethylpyrazol-1-yl-3-oxopropanenitrile,1-cyanoacetyl-3,5-dimethyl-1h-pyrazole,3-3,5-dimethylpyrazolyl-3-oxopropanenitrile,cambridge id 5140887,1h-pyrazole-1-propanenitrile, 3,5-dimethyl-,a-oxo,1,cyanoacetyl-3,5-dimethylpyrazole,1h-pyrazole-1-propanenitrile, 3,5-dimethyl-beta-oxo CID PubChem: 262101 Nom IUPAC: 3-(3,5-dimethylpyrazol-1-yl)-3-oxopropanenitrile SMILES: CC1=CC(=NN1C(=O)CC#N)C

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Poids moléculaire (g/mol)	163.18
Synonyme	1-cyanoacetyl-3,5-dimethylpyrazole,3-3,5-dimethyl-1h-pyrazol-1-yl-3-oxopropanenitrile,3-3,5-dimethylpyrazol-1-yl-3-oxopropanenitrile,1-cyanoacetyl-3,5-dimethyl-1h-pyrazole,3-3,5-dimethylpyrazolyl-3-oxopropanenitrile,cambridge id 5140887,1h-pyrazole-1-propanenitrile, 3,5-dimethyl-,a-oxo,1,cyanoacetyl-3,5-dimethylpyrazole,1h-pyrazole-1-propanenitrile, 3,5-dimethyl-beta-oxo
Numéro MDL	MFCD00051954
CAS	36140-83-7
CID PubChem	262101
Nom IUPAC	3-(3,5-dimethylpyrazol-1-yl)-3-oxopropanenitrile
Clé InChI	DDWZYWSLHBDVGR-UHFFFAOYSA-N
SMILES	CC1=CC(=NN1C(=O)CC#N)C
Formule moléculaire	C8H9N3O

1-Methyl-1H-pyrazole-4-sulfonyl chloride, 97%

CAS: 288148-34-5 Formule moléculaire: C4H5ClN2O2S Poids moléculaire (g/mol): 180.606 Numéro MDL: MFCD04968667 Clé InChI: RDAVKKQKMLINOH-UHFFFAOYSA-N Synonyme: 1-methyl-1h-pyrazole-4-sulfonyl chloride,1h-pyrazole-4-sulfonyl chloride, 1-methyl,chloro 1-methylpyrazol-4-yl sulfone,4-chlorosulphonyl-1-methyl-1h-pyrazole,1-methylpyrazole-4-sulfonylchloride,1-methyl-4-pyrazolesulfonyl chloride,1h-pyrazole-4-sulfonylchloride, 1-methyl,1h-pyrazole-4-sulfonylchloride,1-methyl-9ci,4-chlorosulfonyl-1-methyl-1h-pyrazole,1-methyl-1h-pyrazole-4-sulphonyl chloride CID PubChem: 17024730 Nom IUPAC: 1-methylpyrazole-4-sulfonyl chloride SMILES: CN1C=C(C=N1)S(=O)(=O)Cl

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Poids moléculaire (g/mol)	180.606
Synonyme	1-methyl-1h-pyrazole-4-sulfonyl chloride,1h-pyrazole-4-sulfonyl chloride, 1-methyl,chloro 1-methylpyrazol-4-yl sulfone,4-chlorosulphonyl-1-methyl-1h-pyrazole,1-methylpyrazole-4-sulfonylchloride,1-methyl-4-pyrazolesulfonyl chloride,1h-pyrazole-4-sulfonylchloride, 1-methyl,1h-pyrazole-4-sulfonylchloride,1-methyl-9ci,4-chlorosulfonyl-1-methyl-1h-pyrazole,1-methyl-1h-pyrazole-4-sulphonyl chloride
Numéro MDL	MFCD04968667
CAS	288148-34-5
CID PubChem	17024730
Nom IUPAC	1-methylpyrazole-4-sulfonyl chloride
Clé InChI	RDAVKKQKMLINOH-UHFFFAOYSA-N
SMILES	CN1C=C(C=N1)S(=O)(=O)Cl
Formule moléculaire	C4H5ClN2O2S

3-Trifluoromethyl-1H-pyrazole, 97%

CAS: 20154-03-4 Formule moléculaire: C4H3F3N2 Poids moléculaire (g/mol): 136.077 Numéro MDL: MFCD00115018 Clé InChI: PYXNITNKYBLBMW-UHFFFAOYSA-N Synonyme: 3-trifluoromethyl pyrazole,3-trifluoromethyl-1h-pyrazole,5-trifluoromethyl-1h-pyrazole,3-trifluoromethylpyrazole,trifluoromethylpyrazole,1h-pyrazole, 3-trifluoromethyl,3-trifluoromethyl-2h-pyrazole,pubchem10164,pubchem10423 CID PubChem: 1807034 Nom IUPAC: 5-(trifluoromethyl)-1H-pyrazole SMILES: C1=C(NN=C1)C(F)(F)F

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Poids moléculaire (g/mol)	136.077
Synonyme	3-trifluoromethyl pyrazole,3-trifluoromethyl-1h-pyrazole,5-trifluoromethyl-1h-pyrazole,3-trifluoromethylpyrazole,trifluoromethylpyrazole,1h-pyrazole, 3-trifluoromethyl,3-trifluoromethyl-2h-pyrazole,pubchem10164,pubchem10423
Numéro MDL	MFCD00115018
CAS	20154-03-4
CID PubChem	1807034
Nom IUPAC	5-(trifluoromethyl)-1H-pyrazole
Clé InChI	PYXNITNKYBLBMW-UHFFFAOYSA-N
SMILES	C1=C(NN=C1)C(F)(F)F
Formule moléculaire	C4H3F3N2

6-Amino-3-chloro-1H-indazole, 97%

CAS: 21413-23-0 Formule moléculaire: C7H6ClN3 Poids moléculaire (g/mol): 167.60 Numéro MDL: MFCD07781648 Clé InChI: DRRARKIFTNKQDW-UHFFFAOYSA-N Synonyme: 3-chloro-1h-indazol-6-amine,6-amino-3-chloro-1h-indazole,1h-indazol-6-amine,3-chloro,6-amino-3-chloroindazole,3-chloro-1h-indazole-6-ylamine,3-chloro-1h-indazol-6-ylamine,6-amino-3-chloro 1h indazole,pubchem23042,3-chloro-indazol-6-amine CID PubChem: 14790453 Nom IUPAC: 3-chloro-2H-indazol-6-amine SMILES: NC1=CC2=NNC(Cl)=C2C=C1

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Poids moléculaire (g/mol)	167.60
Synonyme	3-chloro-1h-indazol-6-amine,6-amino-3-chloro-1h-indazole,1h-indazol-6-amine,3-chloro,6-amino-3-chloroindazole,3-chloro-1h-indazole-6-ylamine,3-chloro-1h-indazol-6-ylamine,6-amino-3-chloro 1h indazole,pubchem23042,3-chloro-indazol-6-amine
Numéro MDL	MFCD07781648
CAS	21413-23-0
CID PubChem	14790453
Nom IUPAC	3-chloro-2H-indazol-6-amine
Clé InChI	DRRARKIFTNKQDW-UHFFFAOYSA-N
SMILES	NC1=CC2=NNC(Cl)=C2C=C1
Formule moléculaire	C7H6ClN3

1H-Pyrazole-1-carboxamidine hydrochloride, 99%

CAS: 4023-02-3 Numéro MDL: MFCD00210087 Nom IUPAC: pyrazole-1-carboximidamide;hydrochloride

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Numéro MDL	MFCD00210087
CAS	4023-02-3
Nom IUPAC	pyrazole-1-carboximidamide;hydrochloride

3-Amino-4-ethyl-1H-pyrazole, 98%

CAS: 43024-15-3 Formule moléculaire: C5H9N3 Poids moléculaire (g/mol): 111.15 Numéro MDL: MFCD06797570 Clé InChI: RDCODVKTTJWFAR-UHFFFAOYSA-N Synonyme: 4-ethyl-1h-pyrazol-3-amine,3-amino-4-ethylpyrazole,3-amino-4-ethyl-1h-pyrazole,4-ethyl-2h-pyrazol-3-amine,3-amino-4-ethyl pyrazole,4-ethyl-1h-pyrazol-3-ylamine,1h-pyrazol-3-amine, 4-ethyl CID PubChem: 11789157 Nom IUPAC: 4-ethyl-1H-pyrazol-5-amine SMILES: CCC1=C(N)NN=C1

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Poids moléculaire (g/mol)	111.15
Synonyme	4-ethyl-1h-pyrazol-3-amine,3-amino-4-ethylpyrazole,3-amino-4-ethyl-1h-pyrazole,4-ethyl-2h-pyrazol-3-amine,3-amino-4-ethyl pyrazole,4-ethyl-1h-pyrazol-3-ylamine,1h-pyrazol-3-amine, 4-ethyl
Numéro MDL	MFCD06797570
CAS	43024-15-3
CID PubChem	11789157
Nom IUPAC	4-ethyl-1H-pyrazol-5-amine
Clé InChI	RDCODVKTTJWFAR-UHFFFAOYSA-N
SMILES	CCC1=C(N)NN=C1
Formule moléculaire	C5H9N3

Pyrazoles

Pyrazoles

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