Methyl 2-[(4-bromophenyl)sulfonyl]acetate

CAS Registry Number®

50397-65-4

CAS Name

Methyl 2-[(4-bromophenyl)sulfonyl]acetate

Molecular Formula

C9H9BrO4S

Molecular Mass

293.13

Cite this Page

Methyl 2-[(4-bromophenyl)sulfonyl]acetate.   CAS Common Chemistry.   CAS, a division of the American Chemical Society, n.d.   http://commonchemistry.cas.org/detail?cas_rn=50397-65-4 (retrieved 2024-12-12) (CAS RN: 50397-65-4).  Licensed under the Attribution-Noncommercial 4.0 International License (CC BY-NC 4.0).

Compound Properties

  • Melting Point (1)

    82 °C

Source(s)

  • (1) PhysProp data were obtained from Syracuse Research Corporation of Syracuse, New York (US)

Other Names and Identifiers

InChI

InChI=1S/C9H9BrO4S/c1-14-9(11)6-15(12,13)8-4-2-7(10)3-5-8/h2-5H,6H2,1H3

InChIKey

InChIKey=CNEVNTZDQZVZGP-UHFFFAOYSA-N

SMILES

S(CC(OC)=O)(=O)(=O)C1=CC=C(Br)C=C1

Canonical SMILES

O=C(OC)CS(=O)(=O)C1=CC=C(Br)C=C1

Other Names for this Substance

  • Acetic acid, 2-[(4-bromophenyl)sulfonyl]-, methyl ester
  • Acetic acid, [(4-bromophenyl)sulfonyl]-, methyl ester
  • Methyl 2-[(4-bromophenyl)sulfonyl]acetate
  • (4-Bromo-benzenesulfonyl)-acetic acid methyl ester

CAS INSIGHTSTM
Abstract molecules design, Atoms, Medical background