Methyl 3,5,5-trimethylhexanoate

CAS Registry Number®

71500-39-5

CAS Name

Methyl 3,5,5-trimethylhexanoate

Molecular Formula

C10H20O2

Molecular Mass

172.26

Cite this Page

Methyl 3,5,5-trimethylhexanoate.   CAS Common Chemistry.   CAS, a division of the American Chemical Society, n.d.   http://commonchemistry.cas.org/detail?cas_rn=71500-39-5 (retrieved 2024-11-22) (CAS RN: 71500-39-5).  Licensed under the Attribution-Noncommercial 4.0 International License (CC BY-NC 4.0).

Other Names and Identifiers

InChI

InChI=1S/C10H20O2/c1-8(6-9(11)12-5)7-10(2,3)4/h8H,6-7H2,1-5H3

InChIKey

InChIKey=DCPCIGBOUDWJEZ-UHFFFAOYSA-N

SMILES

C(C(C)(C)C)C(CC(OC)=O)C

Canonical SMILES

O=C(OC)CC(C)CC(C)(C)C

Other Names for this Substance

  • Hexanoic acid, 3,5,5-trimethyl-, methyl ester
  • Methyl 3,5,5-trimethylhexanoate
  • 3,5,5-Trimethylhexanoic acid methyl ester

CAS INSIGHTSTM
Targeted protein degrader structure, illustration