AG0034VC

7234-25-5 | Ethyl 4-methyl-2-(methylthio)pyrimidine-5-carboxylate

AG0034VC

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CAS Number	7234-25-5
Catalog Number	AG0034VC(AGN-PC-0JNK0O)
Chemical Name	Ethyl 4-methyl-2-(methylthio)pyrimidine-5-carboxylate
IUPAC Name	ethyl 4-methyl-2-methylsulfanylpyrimidine-5-carboxylate
InChI	InChI=1S/C9H12N2O2S/c1-4-13-8(12)7-5-10-9(14-3)11-6(7)2/h5H,4H2,1-3H3
InChI Key	LJDJKDAPYUXBPE-UHFFFAOYSA-N
MDL Number	MFCD08457402
Molecular Formula	C9H12N2O2S
Molecular Weight	212.2688
SMILES	CC1=NC(=NC=C1C(=O)OCC)SC
Synonyms	EMTMPC, ethyl 2-methylthio-4-5-pyrimidinecarboxylate, ethyl-2-methylthio-4-methyl-5-pyrimidine carboxylate, S-7, S-7HNa, 7234-25-5, Ethyl 4-methyl-2-(methylthio)pyrimidine-5-carboxylate, Ethyl 4-Methyl-2-(methylthio)-5-pyrimidinecarboxylate, 4-Methyl-2-methylsulfanyl-pyrimidine-5-carboxylic acid ethyl ester, Ethyl-2-methylthio-4-methyl-5-pyrimidine carboxylate, ethyl 4-methyl-2-(methylsulfanyl)pyrimidine-5-carboxylate, 5-Pyrimidinecarboxylic acid, 4-methyl-2-(methylthio)-, ethyl ester, AK112938, Emtmpc, ethyl 4-methyl-2-methylsulfanylpyrimidine-5-carboxylate, S-7HNa, ethyl 4-methyl-2-methylthiopyrimidine-5-carboxylate, ACMC-209omq, AC1L4MDR, Ethyl 2-methylthio-4-5-pyrimidinecarboxylate, AC1Q64LG, SCHEMBL423187, CTK2H8002, KS-00000BPX, DTXSID00222669, LJDJKDAPYUXBPE-UHFFFAOYSA-N, BCP23033, ZINC5858381, ANW-36192, MFCD08457402, SBB017443, STK946255, AKOS001921288, CCG-164997, CS-W003517, MCULE-2579137374, RP26686, TRA0094431, AJ-55092, AS-42864, CJ-12779, HC210543, ST078435, SY022401, AX8168715, DB-074550, TR-033439, FT-0660633, ST24047045, X6092, B-5503, MFCD08457402 (97+%), I03-818, SR-01000158899, J-515710, SR-01000158899-1, Ethyl 2-methylthio-4-methyl-5-pyrimidine carboxylate, Ethyl4-Methyl-2-(methylthio)-5-pyrimidinecarboxylate, ethyl4-methyl-2-(methylthio)pyrimidine-5-carboxylate, ethyl 4-methyl-2-(methylsulfanyl)-5-pyrimidinecarboxylate, 2-(Methylthio)-4-methylpyrimidine-5-carboxylic acid ethyl ester, 4-METHYL-2-METHYLSULFANYL-PYRIMIDINE-5-CARBOXYLICACIDETHYLESTER, C9H12N2O2S, C9-H12-N2-O2-S, AR-1I9268, CID188208, ethyl 4-methyl-2-methylsulfanyl-pyrimidine-5-carboxylate, S-7, 4-Methyl-2-methylsulfanyl-pyrimidine-5-carboxylic acid ethyl ester, 98% - 5G 5g, 93181-78-3,

Complexity	201
Compound Is Canonicalized	Yes
Covalently-Bonded Unit Count	1
Defined Atom Stereocenter Count	0
Defined Bond Stereocenter Count	0
Exact Mass	212.062g/mol
Formal Charge	0
Heavy Atom Count	14
Hydrogen Bond Acceptor Count	5
Hydrogen Bond Donor Count	0
Isotope Atom Count	0
Molecular Weight	212.267g/mol
Monoisotopic Mass	212.062g/mol
Rotatable Bond Count	4
Topological Polar Surface Area	77.4A^2
Undefined Atom Stereocenter Count	0
Undefined Bond Stereocenter Count	0
XLogP3	1.7

GHS Hazard and Precautionary Statements

Symbol:
Hazard Class
Hazard statements	H302-H315-H320-H335
Packing Group
Precautionary statements	P261-P280-P301+P312-P302+P352-P305+P351+P338
Signal Words	warning
UN Code

Certificate of Analysis

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