Ethyl 2-chloro-4-(methylthio)-δ-oxobenzenepentanoate

CAS Registry Number®

951886-89-8
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CAS Name

Ethyl 2-chloro-4-(methylthio)-δ-oxobenzenepentanoate

Molecular Formula

C14H17ClO3S

Molecular Mass

300.80

Cite this Page

Ethyl 2-chloro-4-(methylthio)-δ-oxobenzenepentanoate.   CAS Common Chemistry.   CAS, a division of the American Chemical Society, n.d.   http://commonchemistry.cas.org/detail?cas_rn=951886-89-8 (retrieved 2024-06-27) (CAS RN: 951886-89-8).  Licensed under the Attribution-Noncommercial 4.0 International License (CC BY-NC 4.0).

Other Names and Identifiers

InChI

InChI=1S/C14H17ClO3S/c1-3-18-14(17)6-4-5-13(16)11-8-7-10(19-2)9-12(11)15/h7-9H,3-6H2,1-2H3

InChIKey

InChIKey=KCMQFGOYOAKXCQ-UHFFFAOYSA-N

SMILES

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

Canonical SMILES

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

Other Names for this Substance

  • Benzenepentanoic acid, 2-chloro-4-(methylthio)-δ-oxo-, ethyl ester
  • Ethyl 2-chloro-4-(methylthio)-δ-oxobenzenepentanoate