AG00DC5K

4786-51-0 | 5-Pyrimidinecarboxamide, 4-amino- (6CI,7CI,8CI,9CI)

AG00DC5K

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CAS Number	4786-51-0
Catalog Number	AG00DC5K(AGN-PC-0JWIHV)
Chemical Name	5-Pyrimidinecarboxamide, 4-amino- (6CI,7CI,8CI,9CI)
IUPAC Name	4-aminopyrimidine-5-carboxamide
InChI	InChI=1S/C5H6N4O/c6-4-3(5(7)10)1-8-2-9-4/h1-2H,(H2,7,10)(H2,6,8,9)
InChI Key	LHRPKQMNCPCVQL-UHFFFAOYSA-N
MDL Number	MFCD00193995
Molecular Formula	C5H6N4O
Molecular Weight	138.1273
SMILES	O=C(C1=CN=CN=C1N)N
Synonyms	4-aminopyrimidine-5-carboxamide, 4786-51-0, 4-amino-5-pyrimidinecarboxamide, 5-Pyrimidinecarboxamide, 4-amino-, 5-pyrimidinecarboxamide,4-amino-, AC1LGAUI, Oprea1_220061, AC1Q5D39, SCHEMBL3663171, 5-Pyrimidinecarboxamide, 4-amino- (6CI,7CI,8CI,9CI), CTK7D2979, 4-amino-pyrimidine-5-carboxamide, DTXSID40355920, LHRPKQMNCPCVQL-UHFFFAOYSA-N, ZINC332913, MFCD00193995, SBB039493, AKOS000267581, MCULE-2298654764, AJ-19567, HC210552, 4-Amino-pyrimidine-5-carboxylic acid amide, DB-070868, TR-039334, 4-aminopyrimidine-5-carboxamide, AldrichCPR, FT-0720226, ST50160453, Z2814, C-1187, AF-399/25108091, Z277538306, C5H6N4O, AR-1G0978, CID818212, ZINC00332913, 4-Aminopyrimidine-5-carboxamide, 97% - 1G 1g, 4878-51-7,

Complexity	138
Compound Is Canonicalized	Yes
Covalently-Bonded Unit Count	1
Defined Atom Stereocenter Count	0
Defined Bond Stereocenter Count	0
Exact Mass	138.054g/mol
Formal Charge	0
Heavy Atom Count	10
Hydrogen Bond Acceptor Count	4
Hydrogen Bond Donor Count	2
Isotope Atom Count	0
Molecular Weight	138.13g/mol
Monoisotopic Mass	138.054g/mol
Rotatable Bond Count	1
Topological Polar Surface Area	94.9A^2
Undefined Atom Stereocenter Count	0
Undefined Bond Stereocenter Count	0
XLogP3	-0.7

GHS Hazard and Precautionary Statements

Symbol:
Hazard Class
Hazard statements	H302+H312+H332
Packing Group
Precautionary statements	P280
UN Code

Certificate of Analysis

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