Ethyl 3,5,5-trimethylhexanoate

CAS Registry Number®

67707-75-9
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CAS Name

Ethyl 3,5,5-trimethylhexanoate

Molecular Formula

C11H22O2

Molecular Mass

186.29

Cite this Page

Ethyl 3,5,5-trimethylhexanoate.   CAS Common Chemistry.   CAS, a division of the American Chemical Society, n.d.   http://commonchemistry.cas.org/ChemicalDetail.aspx?ref=67707-75-9 (retrieved 2024-04-27) (CAS RN: 67707-75-9).  Licensed under the Attribution-Noncommercial 4.0 International License (CC BY-NC 4.0).

Compound Properties

  • Boiling Point (1)

    103 °C @ Press: 35 Torr

Source(s)

Other Names and Identifiers

InChI

InChI=1S/C11H22O2/c1-6-13-10(12)7-9(2)8-11(3,4)5/h9H,6-8H2,1-5H3

InChIKey

InChIKey=NMZMQQBBZRGLPJ-UHFFFAOYSA-N

SMILES

C(C(CC(C)(C)C)C)C(OCC)=O

Canonical SMILES

O=C(OCC)CC(C)CC(C)(C)C

Other Names for this Substance

  • Hexanoic acid, 3,5,5-trimethyl-, ethyl ester
  • Ethyl 3,5,5-trimethylhexanoate
  • Melusat

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