Ethyl 2-chloro-4-(methylthio)-γ-oxobenzenebutanoate

CAS Registry Number®

951886-85-4
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CAS Name

Ethyl 2-chloro-4-(methylthio)-γ-oxobenzenebutanoate

Molecular Formula

C13H15ClO3S

Molecular Mass

286.77

Cite this Page

Ethyl 2-chloro-4-(methylthio)-γ-oxobenzenebutanoate.   CAS Common Chemistry.   CAS, a division of the American Chemical Society, n.d.   http://commonchemistry.cas.org/detail?cas_rn=951886-85-4 (retrieved 2024-08-02) (CAS RN: 951886-85-4).  Licensed under the Attribution-Noncommercial 4.0 International License (CC BY-NC 4.0).

Other Names and Identifiers

InChI

InChI=1S/C13H15ClO3S/c1-3-17-13(16)7-6-12(15)10-5-4-9(18-2)8-11(10)14/h4-5,8H,3,6-7H2,1-2H3

InChIKey

InChIKey=QQINEMKKDYRFHQ-UHFFFAOYSA-N

SMILES

C(CCC(OCC)=O)(=O)C1=C(Cl)C=C(SC)C=C1

Canonical SMILES

O=C(OCC)CCC(=O)C1=CC=C(SC)C=C1Cl

Other Names for this Substance

  • Benzenebutanoic acid, 2-chloro-4-(methylthio)-γ-oxo-, ethyl ester
  • Ethyl 2-chloro-4-(methylthio)-γ-oxobenzenebutanoate