Octyl 2-methylbutyrate

CAS Registry Number®

29811-50-5
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CAS Name

Octyl 2-methylbutyrate

Molecular Formula

C13H26O2

Molecular Mass

214.34

Cite this Page

Octyl 2-methylbutyrate.   CAS Common Chemistry.   CAS, a division of the American Chemical Society, n.d.   http://commonchemistry.cas.org/ChemicalDetail.aspx?ref=29811-50-5 (retrieved 2024-04-25) (CAS RN: 29811-50-5).  Licensed under the Attribution-Noncommercial 4.0 International License (CC BY-NC 4.0).

Other Names and Identifiers

InChI

InChI=1S/C13H26O2/c1-4-6-7-8-9-10-11-15-13(14)12(3)5-2/h12H,4-11H2,1-3H3

InChIKey

InChIKey=BCOJVEMHTBSAOE-UHFFFAOYSA-N

SMILES

C(OCCCCCCCC)(C(CC)C)=O

Canonical SMILES

O=C(OCCCCCCCC)C(C)CC

Other Names for this Substance

  • Butanoic acid, 2-methyl-, octyl ester
  • Butyric acid, 2-methyl-, octyl ester
  • Octyl 2-methylbutyrate
  • ENT 33625
  • Octyl 2-methylbutanoate

Deleted or Replaced CAS Registry Numbers

116562-71-1

CAS INSIGHTSTM
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