Ethyl abietate

CAS Registry Number®

631-71-0
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CAS Name

Ethyl abietate

Molecular Formula

C22H34O2

Molecular Mass

330.50

Cite this Page

Ethyl abietate.   CAS Common Chemistry.   CAS, a division of the American Chemical Society, n.d.   http://commonchemistry.cas.org/detail?cas_rn=631-71-0 (retrieved 2024-09-06) (CAS RN: 631-71-0).  Licensed under the Attribution-Noncommercial 4.0 International License (CC BY-NC 4.0).

Compound Properties

  • Melting Point (1)

    66-67 °C

Source(s)

Other Names and Identifiers

InChI

InChI=1S/C22H34O2/c1-6-24-20(23)22(5)13-7-12-21(4)18-10-8-16(15(2)3)14-17(18)9-11-19(21)22/h9,14-15,18-19H,6-8,10-13H2,1-5H3/t18-,19+,21+,22+/m0/s1

InChIKey

InChIKey=AGUBCDYYAKENKG-YVNJGZBMSA-N

SMILES

C[C@@]12[C@]([C@@](C(OCC)=O)(C)CCC1)(CC=C3[C@@]2(CCC(C(C)C)=C3)[H])[H]

Canonical SMILES

O=C(OCC)C1(C)CCCC2(C)C3C(C=C(CC3)C(C)C)=CCC12

Other Names for this Substance

  • 1-Phenanthrenecarboxylic acid, 1,2,3,4,4a,4b,5,6,10,10a-decahydro-1,4a-dimethyl-7-(1-methylethyl)-, ethyl ester, (1R,4aR,4bR,10aR)-
  • Podocarpa-7,13-dien-15-oic acid, 13-isopropyl-, ethyl ester
  • Abietic acid, ethyl ester
  • 1-Phenanthrenecarboxylic acid, 1,2,3,4,4a,4b,5,6,10,10a-decahydro-1,4a-dimethyl-7-(1-methylethyl)-, ethyl ester, [1R-(1α,4aβ,4bα,10aα)]-
  • Ethyl abietate