Dehydroabietal

CAS Registry Number®

13601-88-2
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CAS Name

Dehydroabietal

Molecular Formula

C20H28O

Molecular Mass

284.44

Cite this Page

Dehydroabietal.   CAS Common Chemistry.   CAS, a division of the American Chemical Society, n.d.   http://commonchemistry.cas.org/detail?cas_rn=13601-88-2 (retrieved 2024-09-07) (CAS RN: 13601-88-2).  Licensed under the Attribution-Noncommercial 4.0 International License (CC BY-NC 4.0).

Compound Properties

  • Boiling Point (1)

    190-194 °C @ Press: 2-3 Torr

  • Melting Point (2)

    53-55 °C

Source(s)

Other Names and Identifiers

InChI

InChI=1S/C20H28O/c1-14(2)15-6-8-17-16(12-15)7-9-18-19(3,13-21)10-5-11-20(17,18)4/h6,8,12-14,18H,5,7,9-11H2,1-4H3/t18-,19-,20+/m0/s1

InChIKey

InChIKey=YCLCHPWRGSDZKL-SLFFLAALSA-N

SMILES

C[C@@]12C=3C(CC[C@]1([C@@](C=O)(C)CCC2)[H])=CC(C(C)C)=CC3

Canonical SMILES

O=CC1(C)CCCC2(C3=CC=C(C=C3CCC12)C(C)C)C

Other Names for this Substance

  • 1-Phenanthrenecarboxaldehyde, 1,2,3,4,4a,9,10,10a-octahydro-1,4a-dimethyl-7-(1-methylethyl)-, (1R,4aS,10aR)-
  • Podocarpa-8,11,13-trien-15-al, 13-isopropyl-
  • 1-Phenanthrenecarboxaldehyde, 1,2,3,4,4a,9,10,10a-octahydro-1,4a-dimethyl-7-(1-methylethyl)-, [1R-(1α,4aβ,10aα)]-
  • Abietaldehyde, dehydro-
  • (1R,4aS,10aR)-1,2,3,4,4a,9,10,10a-Octahydro-1,4a-dimethyl-7-(1-methylethyl)-1-phenanthrenecarboxaldehyde

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