AG00DD75

5571-03-9 | 5-Pyrimidinecarboxylic acid, 2-methyl-, methyl ester (7CI,8CI,9CI)

AG00DD75

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CAS Number	5571-03-9
Catalog Number	AG00DD75(AGN-PC-07ASMB)
Chemical Name	5-Pyrimidinecarboxylic acid, 2-methyl-, methyl ester (7CI,8CI,9CI)
IUPAC Name	methyl 2-methylpyrimidine-5-carboxylate
InChI	InChI=1S/C7H8N2O2/c1-5-8-3-6(4-9-5)7(10)11-2/h3-4H,1-2H3
InChI Key	XGWMLJAOJOALRA-UHFFFAOYSA-N
MDL Number	MFCD11111634
Molecular Formula	C7H8N2O2
Molecular Weight	152.1506
SMILES	O=C(C1=CN=C(C)N=C1)OC
Synonyms	methyl 2-methylpyrimidine-5-carboxylate, 5571-03-9, 2-METHYL-PYRIMIDINE-5-CARBOXYLIC ACID METHYL ESTER, Methyl-2-methylpyrimidine-5-carboxylate, PubChem21597, methylmethylpyrimidinecarboxylate, SCHEMBL4128911, CTK5A4061, DTXSID60668589, XGWMLJAOJOALRA-UHFFFAOYSA-N, KS-000029RF, 5-Pyrimidinecarboxylic acid, 2-methyl-, methyl ester (7CI,8CI,9CI), 5600AE, FCH889263, MFCD11111634, ZINC14593174, AKOS006305877, Sodium 2-Methoxy-4-oxoethanesulfonate, ACN-044992, MCULE-3898298527, NE-0701, PB10888, RP10029, AJ-64993, AK153446, SC-32572, AX8246540, DB-072034, TR-019643, CS-0029749, FT-0682732, Q-1225, 2-Methylpyrimidine-5-carboxylic acid methyl ester, I03-0544, J-522053, 2-METHYL-5-PYRIMIDINECARBOXYLIC ACID METHYL ESTER, C7H8N2O2, N/A,

Complexity	141
Compound Is Canonicalized	Yes
Covalently-Bonded Unit Count	1
Defined Atom Stereocenter Count	0
Defined Bond Stereocenter Count	0
Exact Mass	152.059g/mol
Formal Charge	0
Heavy Atom Count	11
Hydrogen Bond Acceptor Count	4
Hydrogen Bond Donor Count	0
Isotope Atom Count	0
Molecular Weight	152.153g/mol
Monoisotopic Mass	152.059g/mol
Rotatable Bond Count	2
Topological Polar Surface Area	52.1A^2
Undefined Atom Stereocenter Count	0
Undefined Bond Stereocenter Count	0
XLogP3	0.4

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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