AG0019EP

138538-42-8 | 4-Pyrimidinecarboxylic acid, 6-methyl-

AG0019EP

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CAS Number	138538-42-8
Catalog Number	AG0019EP(AGN-PC-025G2S)
Chemical Name	4-Pyrimidinecarboxylic acid, 6-methyl-
IUPAC Name	6-methylpyrimidine-4-carboxylic acid
InChI	InChI=1S/C6H6N2O2/c1-4-2-5(6(9)10)8-3-7-4/h2-3H,1H3,(H,9,10)
InChI Key	YSRGRWJKRYESQW-UHFFFAOYSA-N
MDL Number	MFCD09881198
Molecular Formula	C6H6N2O2
Molecular Weight	138.1240
SMILES	O=C(C1=NC=NC(C)=C1)O
Synonyms	6-Methylpyrimidine-4-carboxylic acid, 138538-42-8, 4-PYRIMIDINECARBOXYLIC ACID, 6-METHYL-, SCHEMBL1671322, CTK8G8960, DTXSID70597432, YSRGRWJKRYESQW-UHFFFAOYSA-N, 6686AA, MFCD09881198, ZINC25491367, 4-pyrimidinecarboxylic acid,6-methyl-, 6-methyl-pyrimidine-4-carboxylic acid, AKOS012040020, DS-6446, MCULE-3959886425, PB20450, KS-0000075K, AJ-81998, AK114394, CS-0045929, EN300-82517, Q-1600, F1967-2301, C6H6N2O2, 4-Pyrimidinecarboxylicacid,6-methyl-, 4-Pyrimidinecarboxylic acid, 6-methyl- (9CI),

Complexity	138
Compound Is Canonicalized	Yes
Covalently-Bonded Unit Count	1
Defined Atom Stereocenter Count	0
Defined Bond Stereocenter Count	0
Exact Mass	138.043g/mol
Formal Charge	0
Heavy Atom Count	10
Hydrogen Bond Acceptor Count	4
Hydrogen Bond Donor Count	1
Isotope Atom Count	0
Molecular Weight	138.126g/mol
Monoisotopic Mass	138.043g/mol
Rotatable Bond Count	1
Topological Polar Surface Area	63.1A^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-H335
Packing Group
Precautionary statements	P261-P305+P351+P338
UN Code

Certificate of Analysis

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