4-(2,6,6-Trimethyl-1-cyclohexen-1-yl)-3-buten-2-one

CAS Registry Number®

14901-07-6

CAS Name

4-(2,6,6-Trimethyl-1-cyclohexen-1-yl)-3-buten-2-one

Molecular Formula

C13H20O

Molecular Mass

192.30

Cite this Page

4-(2,6,6-Trimethyl-1-cyclohexen-1-yl)-3-buten-2-one.   CAS Common Chemistry.   CAS, a division of the American Chemical Society, n.d.   http://commonchemistry.cas.org/detail?cas_rn=14901-07-6 (retrieved 2024-11-21) (CAS RN: 14901-07-6).  Licensed under the Attribution-Noncommercial 4.0 International License (CC BY-NC 4.0).

Compound Properties

  • Boiling Point (1)

    127 °C

  • Melting Point (1)

    <25 °C

Source(s)

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

Other Names and Identifiers

InChI

InChI=1S/C13H20O/c1-10-6-5-9-13(3,4)12(10)8-7-11(2)14/h7-8H,5-6,9H2,1-4H3

InChIKey

InChIKey=PSQYTAPXSHCGMF-UHFFFAOYSA-N

SMILES

C(=CC(C)=O)C=1C(C)(C)CCCC1C

Canonical SMILES

O=C(C=CC1=C(C)CCCC1(C)C)C

Other Names for this Substance

  • 3-Buten-2-one, 4-(2,6,6-trimethyl-1-cyclohexen-1-yl)-
  • 4-(2,6,6-Trimethyl-1-cyclohexen-1-yl)-3-buten-2-one
  • 4-(2,6,6-Trimethyl-1-cyclohexenyl)-3-buten-2-one
  • NSC 402758
  • NSC 46137

CAS INSIGHTSTM
Targeted protein degrader structure, illustration