3-Methylhexanal

CAS Registry Number®

19269-28-4
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CAS Name

3-Methylhexanal

Molecular Formula

C7H14O

Molecular Mass

114.19

Cite this Page

3-Methylhexanal.   CAS Common Chemistry.   CAS, a division of the American Chemical Society, n.d.   http://commonchemistry.cas.org/detail?cas_rn=19269-28-4 (retrieved 2024-08-01) (CAS RN: 19269-28-4).  Licensed under the Attribution-Noncommercial 4.0 International License (CC BY-NC 4.0).

Compound Properties

  • Boiling Point (1)

    143 °C

  • Density (2)

    0.8203 g/cm³ @ Temp: 20 °C

Source(s)

Other Names and Identifiers

InChI

InChI=1S/C7H14O/c1-3-4-7(2)5-6-8/h6-7H,3-5H2,1-2H3

InChIKey

InChIKey=ZSJUABCTGCNBPF-UHFFFAOYSA-N

SMILES

C(CCC)(CC=O)C

Canonical SMILES

O=CCC(C)CCC

Other Names for this Substance

  • Hexanal, 3-methyl-
  • 3-Methylhexanal
  • (±)-3-Methylhexanal

Deleted or Replaced CAS Registry Numbers

119181-97-4