Methyl 3-bromo-5-(methylthio)benzoate

CAS Registry Number®

453566-01-3
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CAS Name

Methyl 3-bromo-5-(methylthio)benzoate

Molecular Formula

C9H9BrO2S

Molecular Mass

261.14

Cite this Page

Methyl 3-bromo-5-(methylthio)benzoate.   CAS Common Chemistry.   CAS, a division of the American Chemical Society, n.d.   http://commonchemistry.cas.org/detail?cas_rn=453566-01-3 (retrieved 2024-08-18) (CAS RN: 453566-01-3).  Licensed under the Attribution-Noncommercial 4.0 International License (CC BY-NC 4.0).

Other Names and Identifiers

InChI

InChI=1S/C9H9BrO2S/c1-12-9(11)6-3-7(10)5-8(4-6)13-2/h3-5H,1-2H3

InChIKey

InChIKey=IGRREENPYUIZEV-UHFFFAOYSA-N

SMILES

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

Canonical SMILES

O=C(OC)C=1C=C(Br)C=C(SC)C1

Other Names for this Substance

  • Benzoic acid, 3-bromo-5-(methylthio)-, methyl ester
  • Methyl 3-bromo-5-(methylthio)benzoate
  • 3-Bromo-5-(methylthio)benzoic acid methyl ester