AG003MCN

5334-41-8 | 5-AMINO-1-METHYL-1H-PYRAZOLE-4-CARBONITRILE

AG003MCN

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CAS Number	5334-41-8
Catalog Number	AG003MCN(AGN-PC-0JN9R7)
Chemical Name	5-AMINO-1-METHYL-1H-PYRAZOLE-4-CARBONITRILE
IUPAC Name	5-amino-1-methylpyrazole-4-carbonitrile
InChI	InChI=1S/C5H6N4/c1-9-5(7)4(2-6)3-8-9/h3H,7H2,1H3
InChI Key	MZFBWODPTSTYAI-UHFFFAOYSA-N
MDL Number	MFCD00114569
Molecular Formula	C5H6N4
Molecular Weight	122.1279
SMILES	C1=N[N](C(=C1C#N)N)C
Synonyms	5-amino-1-methyl-1H-pyrazole-4-carbonitrile, 5334-41-8, 5-AMINO-1-METHYLPYRAZOLE-4-CARBONITRILE, 5-Amino-4-cyano-1-methylpyrazole, 5-amino-4-cyano-1-methyl-1,2-pyrazole, 1-Methyl-4-cyano-5-amino-1,2-pyrazole, 1H-pyrazole-4-carbonitrile, 5-amino-1-methyl-, 5-Amino-4-cyano-1-methyl-1H-pyrazole, MZFBWODPTSTYAI-UHFFFAOYSA-N, 3-imino-2-methyl-2,3-dihydro-1H-pyrazole-4-carbonitrile, NSC1412, zlchem 806, PubChem16725, AC1Q3XZZ, AC1L57EI, AC1Q40DQ, NCIOpen2_001676, SCHEMBL175251, CTK8B5908, RSCBB000038, DTXSID90277269, ZLD0266, ZINC169364, ALBB-026367, NSC-1412, ZERO/006199, ANW-50988, CL3430, MFCD00114569, NSC102022, SBB007110, STK299442, AKOS000260472, ZINC100222389, AC-7543, ACN-000154, AN-8891, CS-W002376, LS20813, MCULE-7786885619, NSC-102022, QC-4491, RP09652, SB12160, TRA0026845, 5-amino-1-methyl-pyrazole-4-carbonitrile, AJ-17131, AK-23797, BR-23797, CJ-02445, EN002082, SC-56345, SY007511, ZB009071, AB0006733, AB1000970, ST4123842, TL8003508, TR-032278, AM20100309, BB 0259517, FT-0650444, ST24023811, 1-Methyl-5-amino-1H-pyrazole-4-carbonitrile, EN300-25490, MFCD00114569 (97%), 5-amino-1-methyl-1-H-pyrazole-4-carbonitrile, 5C-010, C-4037, 334A418, AG-826/25038003, I14-3252, J-516661, F3308-2953, InChI=1/C5H6N4/c1-9-5(7)4(2-6)3-8-9/h3H,7H2,1H, 1955506-04-3, null, C5H6N4, AR-1G7164, CID219740, C2834, 5831-17-4,

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	1
Isotope Atom Count	0
Molecular Weight	122.131g/mol
Monoisotopic Mass	122.059g/mol
Rotatable Bond Count	0
Topological Polar Surface Area	67.6A^2
Undefined Atom Stereocenter Count	0
Undefined Bond Stereocenter Count	0
XLogP3	0.2

GHS Hazard and Precautionary Statements

Symbol:
Hazard Class
Hazard statements	H315-H319-H335
Packing Group
Precautionary statements	P261-P305+P351+P338
UN Code

Certificate of Analysis

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