AG001E98

4027-56-9 | 1H-Pyrazole-3-carboxamide, 5-methyl-

AG001E98

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CAS Number	4027-56-9
Catalog Number	AG001E98(AGN-PC-0NL6LB)
Chemical Name	1H-Pyrazole-3-carboxamide, 5-methyl-
IUPAC Name	5-methyl-1H-pyrazole-3-carboxamide
InChI	InChI=1S/C5H7N3O/c1-3-2-4(5(6)9)8-7-3/h2H,1H3,(H2,6,9)(H,7,8)
InChI Key	WRKWQCNJAZPEKK-UHFFFAOYSA-N
MDL Number	MFCD08457678
Molecular Formula	C5H7N3O
Molecular Weight	125.1286
SMILES	O=C(C1=NNC(C)=C1)N
Synonyms	5-methyl-1H-pyrazole-3-carboxamide, 3-Methyl-1H-pyrazole-5-carboxamide, 4027-56-9, 14671-10-4, 1H-Pyrazole-3-carboxamide,N,5-dimethyl-, 5-methyl-1H-pyrazole-3-carboxylic acid amide, ARONIS23990, 3-methylpyrazole-5-carboxamide, 5-methylpyrazole-3-carboxamide, ARONIS023810, SCHEMBL1374372, CTK4I2788, CTK6B4080, ACN-P001161, KS-000046FG, 5-methyl-2H-pyrazole-3-carboxamide, 4470AD, ANW-59672, MFCD06808782, SBB085599, STK260863, ZINC10342264, AKOS000280009, AKOS006239502, AKOS025394675, 1H-Pyrazole-3-carboxamide, 5-methyl-, MCULE-3289950808, RP19628, AC-28100, AJ-59690, AJ-59691, 5-Methyl-1H-pyrazole-3-carboxamide,97%, DB-069982, TC-148417, FT-0660620, ST45053145, Z2991, C-1903, J-517730, C5H7N3O, N,5-Dimethyl-1H-pyrazole-3-carboxamide, 4027-55-8,

Complexity	125
Compound Is Canonicalized	Yes
Covalently-Bonded Unit Count	1
Defined Atom Stereocenter Count	0
Defined Bond Stereocenter Count	0
Exact Mass	125.059g/mol
Formal Charge	0
Heavy Atom Count	9
Hydrogen Bond Acceptor Count	2
Hydrogen Bond Donor Count	2
Isotope Atom Count	0
Molecular Weight	125.131g/mol
Monoisotopic Mass	125.059g/mol
Rotatable Bond Count	1
Topological Polar Surface Area	71.8A^2
Undefined Atom Stereocenter Count	0
Undefined Bond Stereocenter Count	0
XLogP3	-0.2

GHS Hazard and Precautionary Statements

Symbol:
Hazard Class
Hazard statements	H302-H315-H319-H335
Packing Group
Precautionary statements	P261-P305+P351+P338
UN Code

Certificate of Analysis

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