Methyl 2-[(cyanomethyl)sulfonyl]benzoate

methyl 2-(cyanomethylsulfonyl)benzoate

Also Known As: methyl 2-[(cyanomethyl)sulfonyl]benzoate|Maybridge1_004417|methyl 2-(cyanomethylsulfonyl)benzoate|HMS554A17|Methyl 2-((cyanomethyl)sulfonyl)benzoate|methyl 2-(cyanomethanesulfonyl)benzoate|methyl 2-[(cyanomethyl)sulphonyl]benzoate|benzoic acid, 2-[(cyanomethyl)sulfonyl]-, methyl ester|METHYL2-[(CYANOMETHYL)SULFONYL]BENZOATE|Benzoicacid, 2-[(cyanomethyl)sulfonyl]-,methyl ester|BENZOIC ACID,2-(CYANOMETHYL SULFONYL),METHYL ESTER|I14-35177|benzoic acid, 2-((cyanomethyl)sulfonyl)-, methyl ester

Molecular Formula	C10H9NO4S
Molecular Weight	239.02522 g/mol
LogP	0.8
Topological Polar Surface Area	92.6 Ų
Hydrogen Bond Donors	0
Hydrogen Bond Acceptors	5
Rotatable Bonds	4
Exact Mass	239.02522
Monoisotopic Mass	239.02522
Heavy Atoms	16
Complexity	400.0

Chemical Identifiers

CAS Number	175137-52-7
SMILES	COC(=O)C1=CC=CC=C1S(=O)(=O)CC#N
InChIKey	GSBCUUXSBJVYLU-UHFFFAOYSA-N