(-)-β-Elemene

CAS Registry Number®

515-13-9
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CAS Name

(-)-β-Elemene

Molecular Formula

C15H24

Molecular Mass

204.35

Cite this Page

(-)-β-Elemene.   CAS Common Chemistry.   CAS, a division of the American Chemical Society, n.d.   http://commonchemistry.cas.org/ChemicalDetail.aspx?ref=515-13-9 (retrieved 2024-03-29) (CAS RN: 515-13-9).  Licensed under the Attribution-Noncommercial 4.0 International License (CC BY-NC 4.0).

Compound Properties

  • Boiling Point (1)

    119 °C @ Press: 15 Torr
  • Density (1)

    0.8881 g/cm³ @ Temp: 20 °C

Source(s)

Other Names and Identifiers

InChI

InChI=1S/C15H24/c1-7-15(6)9-8-13(11(2)3)10-14(15)12(4)5/h7,13-14H,1-2,4,8-10H2,3,5-6H3/t13-,14+,15-/m1/s1

InChIKey

InChIKey=OPFTUNCRGUEPRZ-QLFBSQMISA-N

SMILES

C(C)(=C)[C@H]1[C@@](C=C)(C)CC[C@@H](C(C)=C)C1

Canonical SMILES

C=CC1(C)CCC(C(=C)C)CC1C(=C)C

Other Names for this Substance

  • Cyclohexane, 1-ethenyl-1-methyl-2,4-bis(1-methylethenyl)-, (1S,2S,4R)-
  • β-Elemene
  • Cyclohexane, 2,4-diisopropenyl-1-methyl-1-vinyl-, (1S,2S,4R)-(-)-
  • Cyclohexane, 1-ethenyl-1-methyl-2,4-bis(1-methylethenyl)-, [1S-(1α,2β,4β)]-
  • (1S,2S,4R)-1-Ethenyl-1-methyl-2,4-bis(1-methylethenyl)cyclohexane

Deleted or Replaced CAS Registry Numbers

11033-44-6, 20296-36-0, 154028-29-2

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