AG00EE6M

6345-43-3 | Dimethyl pyrimidine-4,6-dicarboxylate

AG00EE6M

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CAS Number	6345-43-3
Catalog Number	AG00EE6M(AGN-PC-0JOEQJ)
Chemical Name	Dimethyl pyrimidine-4,6-dicarboxylate
EC Number	929-172-3
IUPAC Name	dimethyl pyrimidine-4,6-dicarboxylate
InChI	InChI=1S/C8H8N2O4/c1-13-7(11)5-3-6(8(12)14-2)10-4-9-5/h3-4H,1-2H3
InChI Key	AJTJKDWVSIIOIR-UHFFFAOYSA-N
MDL Number	MFCD05864412
Molecular Formula	C8H8N2O4
Molecular Weight	196.1601
NSC Number	44349
SMILES	O=C(C1=NC=NC(C(OC)=O)=C1)OC
Synonyms	dimethyl pyrimidine-4,6-dicarboxylate, 6345-43-3, 4,6-DIMETHYL PYRIMIDINE-4,6-DICARBOXYLATE, DIMETHYL 4,6-PYRIMIDINEDICARBOXYLATE, AK116342, pyrimidine-4,6-dicarboxylic acid dimethyl ester, methyl 6-(methoxycarbonyl)pyrimidine-4-carboxylate, NSC44349, AC1Q5ZEP, AC1L62YI, SCHEMBL4000055, CTK5B9296, DTXSID70286238, AJTJKDWVSIIOIR-UHFFFAOYSA-N, ZINC1676706, MFCD05864412, NSC-44349, SBB059486, AKOS006344013, MCULE-4593003872, PB12841, AJ-29455, CJ-27400, NS-01932, AX8125465, BB 0257619, CS-0045800, FT-0693241, ST51044462, KS-00000726, 4,6-Pyrimidinedicarboxylic acid, dimethyl ester, Q-1201, 4,6-Pyrimidinedicarboxylicacid, 4,6-dimethyl ester, Dimethylpyrimidine-4,6-dicarboxylate, AR-1I5705, CID239362, 7251-52-7,

Complexity	209
Compound Is Canonicalized	Yes
Covalently-Bonded Unit Count	1
Defined Atom Stereocenter Count	0
Defined Bond Stereocenter Count	0
Exact Mass	196.048g/mol
Formal Charge	0
Heavy Atom Count	14
Hydrogen Bond Acceptor Count	6
Hydrogen Bond Donor Count	0
Isotope Atom Count	0
Molecular Weight	196.162g/mol
Monoisotopic Mass	196.048g/mol
Rotatable Bond Count	4
Topological Polar Surface Area	78.4A^2
Undefined Atom Stereocenter Count	0
Undefined Bond Stereocenter Count	0
XLogP3	0.6

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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