(1S,2S,5R)-2,6,6-Trimethylbicyclo[3.1.1]heptan-3-one

CAS Registry Number®

14575-93-0

CAS Name

(1S,2S,5R)-2,6,6-Trimethylbicyclo[3.1.1]heptan-3-one

Molecular Formula

C10H16O

Molecular Mass

152.23

Cite this Page

(1S,2S,5R)-2,6,6-Trimethylbicyclo[3.1.1]heptan-3-one.   CAS Common Chemistry.   CAS, a division of the American Chemical Society, n.d.   http://commonchemistry.cas.org/detail?cas_rn=14575-93-0 (retrieved 2024-11-29) (CAS RN: 14575-93-0).  Licensed under the Attribution-Noncommercial 4.0 International License (CC BY-NC 4.0).

Compound Properties

  • Boiling Point (1)

    212 °C

Source(s)

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

Other Names and Identifiers

InChI

InChI=1S/C10H16O/c1-6-8-4-7(5-9(6)11)10(8,2)3/h6-8H,4-5H2,1-3H3/t6-,7+,8-/m0/s1

InChIKey

InChIKey=MQPHVIPKLRXGDJ-RNJXMRFFSA-N

SMILES

CC1(C)[C@]2(C[C@@]1(CC(=O)[C@H]2C)[H])[H]

Canonical SMILES

O=C1CC2CC(C1C)C2(C)C

Other Names for this Substance

  • Bicyclo[3.1.1]heptan-3-one, 2,6,6-trimethyl-, (1S,2S,5R)-
  • 3-Pinanone, (1S,2S,5R)-(-)-
  • Bicyclo[3.1.1]heptan-3-one, 2,6,6-trimethyl-, [1S-(1α,2β,5α)]-
  • (1S,2S,5R)-2,6,6-Trimethylbicyclo[3.1.1]heptan-3-one
  • (-)-10β-Pinan-3-one

CAS INSIGHTSTM
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