RefChem:504688 structure

RefChem:504688

1-oxo-2,3-dihydropyrrolo[2,1-b][1,3]benzothiazole-3a-carboxylic acid

Also Known As: 1-Oxo-2,3-dihydro-1H-benzo[d]pyrrolo[2,1-b]-thiazole-3a-carboxylic acid|2,6-Dichloro-4-(methylsulfonyl)aniline|NCGC01448861-01|BAS 12541867|1-oxo-2,3-dihydropyrrolo[2,1-b][1,3]benzothiazole-3a(1H)-carboxylic acid|1-oxo-2,3-dihydropyrrolo[2,1-b][1,3]benzothiazole-3a-carboxylic acid|2,3-Dihydro-1-oxopyrrolo[2,1-b]benzothiazole-3a(1H)-carboxylic acid|1-Oxo-1,2,3,3a-tetrahydrobenzo[d]pyrrolo[2,1-b]thiazole-3a-carboxylic acid|1-Oxo-2,3-dihydro-1H-benzo[d]pyrrolo[2,1-b]thiazole-3a-carboxylic acid|SR-01000325112-1|BRD-A37694238-001-08-1|1-oxo-9,3a-dihydropyrrolidino[2,1-b]benzothiazol-3a-carboxylic acid|3-oxo-7-thia-2-azatricyclo[6.4.0.0,2,6]dodeca-1(12),8,10-triene-6-carboxylic acid|3-oxo-7-thia-2-azatricyclo[6.4.0.0?,?]dodeca-1(12),8,10-triene-6-carboxylic acid|1-Oxo-1,2,3,3a-tetrahydrobenzo[d]pyrrolo[2,1-b]thiazole-3a-carboxylicacid|1-oxo-1,2,3,3a-tetrahydropyrrolo<2,1-b>benzothiazol-3a-carboxylic acid|1-Oxo-2,3-dihydropyrrolo[2,1-b]benzothiazole-3a(1H)-carboxylic acid|1-OXO-2,3-DIHYDROBENZO[D]PYRROLO[2,1-B]THIAZOLE-3A(1H)-CARBOXYLIC ACID|3-Oxo-7-thia-2-azatricyclo(6.4.0.0,2,6)dodeca-1(12),8,10-triene-6-carboxylic acid|3-oxo-7-thia-2-azatricyclo[6.4.0.0(2),?]dodeca-1(8),9,11-triene-6-carboxylic acid|3-oxo-7-thia-2-azatricyclo[6.4.0.02,6]dodeca-1(12),8,10-triene-6-carboxylic acid

CAS: 80866-96-2
Molecular Formula C11H9NO3S
Molecular Weight 235.03032 g/mol
LogP 1.7
Topological Polar Surface Area 57.61 Ų
Hydrogen Bond Donors 1
Hydrogen Bond Acceptors 3
Rotatable Bonds 1
Exact Mass 235.03032
Monoisotopic Mass 235.03032
Heavy Atoms 16
Complexity 501.75797

Chemical Identifiers

CAS Number 80866-96-2
SMILES C1CC2(N(C1=O)C3=CC=CC=C3S2)C(=O)O

Product Overview

RefChem:504688 (CAS 80866-96-2), with molecular formula C11H9NO3S and molecular weight 235.03032 g/mol. IUPAC: 1-oxo-2,3-dihydropyrrolo[2,1-b][1,3]benzothiazole-3a-carboxylic acid.

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