4-[(Phenylmethyl)sulfonyl]benzoic acid
CAS Registry Number®
70793-11-2
CAS Name
4-[(Phenylmethyl)sulfonyl]benzoic acidMolecular Formula
C14H12O4SMolecular Mass
276.31Cite this Page
4-[(Phenylmethyl)sulfonyl]benzoic acid. CAS Common Chemistry. CAS, a division of the American Chemical Society, n.d. http://commonchemistry.cas.org/detail?cas_rn=70793-11-2 (retrieved ) (CAS RN: 70793-11-2). Licensed under the Attribution-Noncommercial 4.0 International License (CC BY-NC 4.0).Compound Properties
Melting Point (1)
270-273 °C
Source(s)
- (1) Denotes property values from the ZIC/VINITI data file provided by InfoChem.
Other Names and Identifiers
InChI
InChI=1S/C14H12O4S/c15-14(16)12-6-8-13(9-7-12)19(17,18)10-11-4-2-1-3-5-11/h1-9H,10H2,(H,15,16)
InChIKey
InChIKey=PCISPSYBKMGNFW-UHFFFAOYSA-N
SMILES
S(CC1=CC=CC=C1)(=O)(=O)C2=CC=C(C(O)=O)C=C2
Canonical SMILES
O=C(O)C1=CC=C(C=C1)S(=O)(=O)CC=2C=CC=CC2
Other Names for this Substance
- Benzoic acid, 4-[(phenylmethyl)sulfonyl]-
- 4-[(Phenylmethyl)sulfonyl]benzoic acid
- 4-(Benzylsulfonyl)benzoic acid
