4,7-Epoxyazulen-3(2H)-one, octahydro-1,4-dimethyl-7-(1-methylethyl)-, (1R,3aS,4R,7S,8aR)-

CAS Registry Number®

3466-16-8

CAS Name

4,7-Epoxyazulen-3(2H)-one, octahydro-1,4-dimethyl-7-(1-methylethyl)-, (1R,3aS,4R,7S,8aR)-

Molecular Formula

C15H24O2

Molecular Mass

236.35

Cite this Page

4,7-Epoxyazulen-3(2H)-one, octahydro-1,4-dimethyl-7-(1-methylethyl)-, (1R,3aS,4R,7S,8aR)-.   CAS Common Chemistry.   CAS, a division of the American Chemical Society, n.d.   http://commonchemistry.cas.org/detail?cas_rn=3466-16-8 (retrieved 2024-12-23) (CAS RN: 3466-16-8).  Licensed under the Attribution-Noncommercial 4.0 International License (CC BY-NC 4.0).

Compound Properties

  • Melting Point (1)

    109-110 °C

Source(s)

Other Names and Identifiers

InChI

InChI=1S/C15H24O2/c1-9(2)15-6-5-14(4,17-15)13-11(8-15)10(3)7-12(13)16/h9-11,13H,5-8H2,1-4H3/t10-,11-,13-,14-,15+/m1/s1

InChIKey

InChIKey=CSLBUZGPLRECOR-BBIZWXPBSA-N

SMILES

C[C@@]12[C@@]3([C@](C[C@@]([C@@H](C)C)(O1)CC2)([C@H](C)CC3=O)[H])[H]

Canonical SMILES

O=C1CC(C)C2CC3(OC(C)(CC3)C12)C(C)C

Other Names for this Substance

  • 4,7-Epoxyazulen-3(2H)-one, octahydro-1,4-dimethyl-7-(1-methylethyl)-, (1R,3aS,4R,7S,8aR)-
  • 1β,4βH,5β-Guaian-2-one, 7,10-epoxy-
  • β-Kessyl ketone
  • 4,7-Epoxyazulen-3(2H)-one, octahydro-1,4-dimethyl-7-(1-methylethyl)-, [1R-(1α,3aβ,4α,7α,8aβ)]-

CAS INSIGHTSTM
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