Catalog Number:
AG005MT1
Chemical Name:
Cyclohexanecarboxylic acid, 1-(phenylsulfonyl)-
CAS Number:
74254-66-3
Molecular Formula:
C13H16O4S
Molecular Weight:
268.3287
MDL Number:
MFCD12074408
IUPAC Name:
1-(benzenesulfonyl)cyclohexane-1-carboxylic acid
InChI:
InChI=1S/C13H16O4S/c14-12(15)13(9-5-2-6-10-13)18(16,17)11-7-3-1-4-8-11/h1,3-4,7-8H,2,5-6,9-10H2,(H,14,15)
InChI Key:
QIDSTHQKFFPEIH-UHFFFAOYSA-N
SMILES:
OC(=O)C1(CCCCC1)S(=O)(=O)c1ccccc1