Valeranone

CAS Registry Number®

55528-90-0

CAS Name

Valeranone

Molecular Formula

C15H26O

Molecular Mass

222.37

Cite this Page

Valeranone.   CAS Common Chemistry.   CAS, a division of the American Chemical Society, n.d.   http://commonchemistry.cas.org/detail?cas_rn=55528-90-0 (retrieved 2024-11-21) (CAS RN: 55528-90-0).  Licensed under the Attribution-Noncommercial 4.0 International License (CC BY-NC 4.0).

Compound Properties

  • Boiling Point (1)

    155-156 °C @ Press: 11 Torr

  • Density (2)

    0.9712 g/cm³ @ Temp: 20 °C

Source(s)

Other Names and Identifiers

InChI

InChI=1/C15H26O/c1-11(2)12-7-9-14(3)8-5-6-13(16)15(14,4)10-12/h11-12H,5-10H2,1-4H3/t12-,14+,15+/s2

InChIKey

InChIKey=HDVXJTYHXDVWQO-URXHZYQANA-N

SMILES

C[C@@]12[C@@](C)(CC[C@H](C(C)C)C1)CCCC2=O

Canonical SMILES

O=C1CCCC2(C)CCC(CC12C)C(C)C

Other Names for this Substance

  • 1(2H)-Naphthalenone, octahydro-4a,8a-dimethyl-7-(1-methylethyl)-, (4aR,7S,8aS)-rel-
  • Valeranone
  • 1(2H)-Naphthalenone, octahydro-4a,8a-dimethyl-7-(1-methylethyl)-, (4aα,7β,8aα)-
  • 1(2H)-Naphthalenone, octahydro-7β-isopropyl-4aα,8aα-dimethyl-
  • rel-(4aR,7S,8aS)-Octahydro-4a,8a-dimethyl-7-(1-methylethyl)-1(2H)-naphthalenone

View All

Deleted or Replaced CAS Registry Numbers

50302-14-2

CAS INSIGHTSTM
Targeted protein degrader structure, illustration