3,5,5-Trimethylhexanoyl chloride

CAS Registry Number®

36727-29-4
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CAS Name

3,5,5-Trimethylhexanoyl chloride

Molecular Formula

C9H17ClO

Molecular Mass

176.68

Cite this Page

3,5,5-Trimethylhexanoyl chloride.   CAS Common Chemistry.   CAS, a division of the American Chemical Society, n.d.   http://commonchemistry.cas.org/ChemicalDetail.aspx?ref=36727-29-4 (retrieved 2024-04-28) (CAS RN: 36727-29-4).  Licensed under the Attribution-Noncommercial 4.0 International License (CC BY-NC 4.0).

Compound Properties

  • Boiling Point (1)

    188-190 °C @ Press: 760 Torr

Source(s)

Other Names and Identifiers

InChI

InChI=1S/C9H17ClO/c1-7(5-8(10)11)6-9(2,3)4/h7H,5-6H2,1-4H3

InChIKey

InChIKey=GEKPNPPFAYJZRD-UHFFFAOYSA-N

SMILES

C(C(C)(C)C)C(CC(Cl)=O)C

Canonical SMILES

O=C(Cl)CC(C)CC(C)(C)C

Other Names for this Substance

  • Hexanoyl chloride, 3,5,5-trimethyl-
  • 3,5,5-Trimethylhexanoyl chloride
  • 3,5,5-Trimethylhexanoic acid chloride
  • Isononanoic acid chloride
  • 2,4,4-Trimethylhexanoyl chloride

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