3-Methylbutyl stearate

CAS Registry Number®

627-88-3

CAS Name

3-Methylbutyl stearate

Molecular Formula

C23H46O2

Molecular Mass

354.61

Cite this Page

3-Methylbutyl stearate.   CAS Common Chemistry.   CAS, a division of the American Chemical Society, n.d.   http://commonchemistry.cas.org/detail?cas_rn=627-88-3 (retrieved 2025-01-03) (CAS RN: 627-88-3).  Licensed under the Attribution-Noncommercial 4.0 International License (CC BY-NC 4.0).

Compound Properties

  • Melting Point (1)

    25.5 °C

Source(s)

  • (1) PhysProp data were obtained from Syracuse Research Corporation of Syracuse, New York (US)

Other Names and Identifiers

InChI

InChI=1S/C23H46O2/c1-4-5-6-7-8-9-10-11-12-13-14-15-16-17-18-19-23(24)25-21-20-22(2)3/h22H,4-21H2,1-3H3

InChIKey

InChIKey=WDQOEAOLRIMQDA-UHFFFAOYSA-N

SMILES

C(CCCCCCCCCCCCCCCC)C(OCCC(C)C)=O

Canonical SMILES

O=C(OCCC(C)C)CCCCCCCCCCCCCCCCC

Other Names for this Substance

  • Octadecanoic acid, 3-methylbutyl ester
  • Stearic acid, isopentyl ester
  • Isopentyl alcohol, stearate
  • 3-Methylbutyl stearate

Deleted or Replaced CAS Registry Numbers

78271-33-7