AG000G7G

115581-36-7 | Pyrimidine, 2-chloro-5-(methylthio)-

AG000G7G

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CAS Number	115581-36-7
Catalog Number	AG000G7G(AGN-PC-03IKRB)
Chemical Name	Pyrimidine, 2-chloro-5-(methylthio)-
IUPAC Name	2-chloro-5-methylsulfanylpyrimidine
InChI	InChI=1S/C5H5ClN2S/c1-9-4-2-7-5(6)8-3-4/h2-3H,1H3
InChI Key	UGWJTFHCCZHCDI-UHFFFAOYSA-N
MDL Number	MFCD22044944
Molecular Formula	C5H5ClN2S
Molecular Weight	160.6246
SMILES	ClC1=NC=C(C=N1)SC
Synonyms	2-chloro-5-(methylthio)pyrimidine, 115581-36-7, Pyrimidine, 2-chloro-5-(methylthio)-, SCHEMBL2697579, 2-chloro-5-methylthiopyrimidine, UGWJTFHCCZHCDI-UHFFFAOYSA-N, 5-methylsulfanyl-2-chloropyrimidine, 2-chloro-5-methylsulfanyl-pyrimidine, MFCD22044944, ZINC98178196, 2-chloro-5-(methylsulfanyl)pyrimidine, AKOS022187831, DS-8793, AK147845, AJ-139301, CS-0031678, FT-0761364,

Complexity	83
Compound Is Canonicalized	Yes
Covalently-Bonded Unit Count	1
Defined Atom Stereocenter Count	0
Defined Bond Stereocenter Count	0
Exact Mass	159.986g/mol
Formal Charge	0
Heavy Atom Count	9
Hydrogen Bond Acceptor Count	3
Hydrogen Bond Donor Count	0
Isotope Atom Count	0
Molecular Weight	160.619g/mol
Monoisotopic Mass	159.986g/mol
Rotatable Bond Count	1
Topological Polar Surface Area	51.1A^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-H319-H335
Packing Group
Precautionary statements	P261-P305+P351+P338
UN Code

Certificate of Analysis

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