Methyl [(1,1-dioxido-1,2-benzothiazol-3-yl)sulfanyl]acetate

methyl 2-[(1,1-dioxo-1,2-benzothiazol-3-yl)sulfanyl]acetate

Also Known As: Oprea1_236020|Oprea1_557005|BAS 00790391|methyl [(1,1-dioxido-1,2-benzothiazol-3-yl)sulfanyl]acetate|methyl 2-[(1,1-dioxo-1,2-benzothiazol-3-yl)sulfanyl]acetate|SR-01000511459-1|A0837/0039238|methyl 2-(1,1-dioxobenzo[d]1,2-thiazol-3-ylthio)acetate|methyl 2-[(1,1-dioxo-1lambda,2-benzothiazol-3-yl)sulfanyl]acetate|METHYL 2-[(1,1-DIOXO-1??,2-BENZOTHIAZOL-3-YL)SULFANYL]ACETATE|2-[(1,1-dioxo-1,2-benzothiazol-3-yl)thio]acetic acid methyl ester|2-[(1,1-diketo-1,2-benzothiazol-3-yl)thio]acetic acid methyl ester|METHYL 2-[(1,1-DIOXO-1H-1,2-BENZISOTHIAZOL-3-YL)SULFANYL]ACETATE|methyl 2-[[1,1-bis(oxidanylidene)-1,2-benzothiazol-3-yl]sulfanyl]ethanoate

Molecular Formula	C10H9NO4S2
Molecular Weight	270.9973 g/mol
LogP	1.5
Topological Polar Surface Area	106.0 Ų
Hydrogen Bond Donors	0
Hydrogen Bond Acceptors	6
Rotatable Bonds	4
Exact Mass	270.9973
Monoisotopic Mass	270.9973
Heavy Atoms	17
Complexity	438.0

Chemical Identifiers

CAS Number	85524-16-9
SMILES	COC(=O)CSC1=NS(=O)(=O)C2=CC=CC=C21
InChIKey	AJCJFCAMKAYRGQ-UHFFFAOYSA-N