AG00DACP

5453-07-6 | 3-Amino-4-cyano-5-methylpyrazole

AG00DACP

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CAS Number	5453-07-6
Catalog Number	AG00DACP(AGN-PC-0JO6SW)
Chemical Name	3-Amino-4-cyano-5-methylpyrazole
IUPAC Name	3-amino-5-methyl-1H-pyrazole-4-carbonitrile
InChI	InChI=1S/C5H6N4/c1-3-4(2-6)5(7)9-8-3/h1H3,(H3,7,8,9)
InChI Key	CRRHJAMDQMQGKG-UHFFFAOYSA-N
MDL Number	MFCD02020550
Molecular Formula	C5H6N4
Molecular Weight	122.1279
NSC Number	19055
SMILES	CC1=NNC(N)=C1C#N
Synonyms	5-amino-3-methyl-1H-pyrazole-4-carbonitrile, 5453-07-6, 3-Amino-5-methyl-1H-pyrazole-4-carbonitrile, 3-Amino-4-cyano-5-methylpyrazole, 5-Amino-4-cyano-3-methylpyrazole, NSC19055, 1H-Pyrazole-4-carbonitrile, 3-amino-5-methyl-, 1204294-67-6, 3-Imino-5-methyl-2,3-dihydro-1H-pyrazole-4-carbonitrile, AC1L5FIF, ACMC-2097hs, SCHEMBL163701, AC1Q4R92, CTK5A1473, CTK7C6545, RSCBB000034, DTXSID10202937, CRRHJAMDQMQGKG-UHFFFAOYSA-N, HMS1629J13, 3-amino-4-cyano-5-methyl-pyrazole, ALBB-027427, KS-00003MP4, ZINC4353708, ANW-13982, MFCD00128276, MFCD02020550, NSC 19055, NSC-19055, 3-amino-4-cyano-5-methyl -pyrazole, AKOS003261382, AKOS006228718, AB03578, KD-0730, MCULE-9429033713, RP09653, RP19465, 3-Amino-4-cyano-5-methyl-1H-pyrazole, 5-amino-4-cyano-3-methyl-1h-pyrazole, KS-00001A59, 3-amino-5-methylpyrazole-4-carbonitrile, 3-methyl-5-aminopyrazole-4-carbonitrile, 5-amino-3-methyl-4-pyrazolecarbonitrile, 5-amino-3-methylpyrazole-4-carbonitrile, 5-amino-3-methyl-4-pyrazole carbonitrile, AJ-50857, AK-68107, AM804026, CJ-11995, CS-10748, DB-071866, TR-019280, CS-0033797, FT-0732274, R5328, ST24044327, V6532, 3-amino-5-methyl-2H-pyrazole-4-carbonitrile, 1H-Pyrazole-4-carbonitrile,3-amino-5-methyl-, A-5697, A80010, 1H-pyrazole-4-carbonitrile, 5-amino-3-methyl-, J-516714, 3-imino-5-methyl-1,2-dihydropyrazole-4-carbonitrile, Z1404601485, 5-Amino-3-methyl-1H-pyrazole-4-carbonitrile, AldrichCPR, C5H6N4, AR-1G7143, CID227460, 10288-11-6,

Complexity	146
Compound Is Canonicalized	Yes
Covalently-Bonded Unit Count	1
Defined Atom Stereocenter Count	0
Defined Bond Stereocenter Count	0
Exact Mass	122.059g/mol
Formal Charge	0
Heavy Atom Count	9
Hydrogen Bond Acceptor Count	3
Hydrogen Bond Donor Count	2
Isotope Atom Count	0
Molecular Weight	122.131g/mol
Monoisotopic Mass	122.059g/mol
Rotatable Bond Count	0
Topological Polar Surface Area	78.5A^2
Undefined Atom Stereocenter Count	0
Undefined Bond Stereocenter Count	0
XLogP3	0.5

GHS Hazard and Precautionary Statements

Symbol:
Hazard Class
Hazard statements	H302-H315-H319-H332-H335
Packing Group
Precautionary statements	P280-P305+P351+P338-P310
UN Code

Certificate of Analysis

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