β-Iraldeine

CAS Registry Number®

127-43-5

CAS Name

β-Iraldeine

Molecular Formula

C14H22O

Molecular Mass

206.32

Cite this Page

β-Iraldeine.   CAS Common Chemistry.   CAS, a division of the American Chemical Society, n.d.   http://commonchemistry.cas.org/detail?cas_rn=127-43-5 (retrieved 2024-11-22) (CAS RN: 127-43-5).  Licensed under the Attribution-Noncommercial 4.0 International License (CC BY-NC 4.0).

Compound Properties

  • Boiling Point (1)

    133 °C

  • Density (2)

    0.9338 g/cm³ @ Temp: 25 °C

Source(s)

Other Names and Identifiers

InChI

InChI=1S/C14H22O/c1-5-12(15)8-9-13-11(2)7-6-10-14(13,3)4/h8-9H,5-7,10H2,1-4H3

InChIKey

InChIKey=LMWNGLDCJDIIBR-UHFFFAOYSA-N

SMILES

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

Canonical SMILES

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

Other Names for this Substance

  • 1-Penten-3-one, 1-(2,6,6-trimethyl-1-cyclohexen-1-yl)-
  • 1-(2,6,6-Trimethyl-1-cyclohexen-1-yl)-1-penten-3-one
  • β-Iraldeine
  • 5-(2,6,6-Trimethyl-1-cyclohexen-1-yl)-4-penten-3-one
  • NSC 163995

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CAS INSIGHTSTM
Targeted protein degrader structure, illustration