Ethyl 3,4-dimethyl-ε-oxobenzenehexanoate

CAS Registry Number®

898793-09-4

CAS Name

Ethyl 3,4-dimethyl-ε-oxobenzenehexanoate

Molecular Formula

C16H22O3

Molecular Mass

262.34

Cite this Page

Ethyl 3,4-dimethyl-ε-oxobenzenehexanoate.   CAS Common Chemistry.   CAS, a division of the American Chemical Society, n.d.   http://commonchemistry.cas.org/detail?cas_rn=898793-09-4 (retrieved 2024-10-05) (CAS RN: 898793-09-4).  Licensed under the Attribution-Noncommercial 4.0 International License (CC BY-NC 4.0).

Other Names and Identifiers

InChI

InChI=1S/C16H22O3/c1-4-19-16(18)8-6-5-7-15(17)14-10-9-12(2)13(3)11-14/h9-11H,4-8H2,1-3H3

InChIKey

InChIKey=PDGPQEGQFXROHL-UHFFFAOYSA-N

SMILES

C(CCCCC(OCC)=O)(=O)C1=CC(C)=C(C)C=C1

Canonical SMILES

O=C(OCC)CCCCC(=O)C1=CC=C(C(=C1)C)C

Other Names for this Substance

  • Benzenehexanoic acid, 3,4-dimethyl-ε-oxo-, ethyl ester
  • Ethyl 3,4-dimethyl-ε-oxobenzenehexanoate

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