Ethyl 2,6,6-trimethyl-2,4-cyclohexadiene-1-carboxylate

CAS Registry Number®

35044-57-6

CAS Name

Ethyl 2,6,6-trimethyl-2,4-cyclohexadiene-1-carboxylate

Molecular Formula

C12H18O2

Molecular Mass

194.27

Cite this Page

Ethyl 2,6,6-trimethyl-2,4-cyclohexadiene-1-carboxylate.   CAS Common Chemistry.   CAS, a division of the American Chemical Society, n.d.   http://commonchemistry.cas.org/detail?cas_rn=35044-57-6 (retrieved 2024-11-28) (CAS RN: 35044-57-6).  Licensed under the Attribution-Noncommercial 4.0 International License (CC BY-NC 4.0).

Compound Properties

  • Boiling Point (1)

    102-103 °C @ Press: 12 Torr

Source(s)

Other Names and Identifiers

InChI

InChI=1S/C12H18O2/c1-5-14-11(13)10-9(2)7-6-8-12(10,3)4/h6-8,10H,5H2,1-4H3

InChIKey

InChIKey=ZANQMOGWQBCGBN-UHFFFAOYSA-N

SMILES

C(OCC)(=O)C1C(C)(C)C=CC=C1C

Canonical SMILES

O=C(OCC)C1C(=CC=CC1(C)C)C

Other Names for this Substance

  • 2,4-Cyclohexadiene-1-carboxylic acid, 2,6,6-trimethyl-, ethyl ester
  • Ethyl 2,6,6-trimethyl-2,4-cyclohexadiene-1-carboxylate
  • Ethyl α-safranate
  • 2,6,6-Trimethyl-1-ethoxycarbonylcyclohexa-2,4-diene

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