(5α)-Pregnane

CAS Registry Number®

641-85-0

CAS Name

(5α)-Pregnane

Molecular Formula

C21H36

Molecular Mass

288.51

Cite this Page

(5α)-Pregnane.   CAS Common Chemistry.   CAS, a division of the American Chemical Society, n.d.   http://commonchemistry.cas.org/detail?cas_rn=641-85-0 (retrieved 2024-11-22) (CAS RN: 641-85-0).  Licensed under the Attribution-Noncommercial 4.0 International License (CC BY-NC 4.0).

Compound Properties

  • Melting Point (1)

    84.5 °C

Source(s)

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

Other Names and Identifiers

InChI

InChI=1S/C21H36/c1-4-15-9-11-18-17-10-8-16-7-5-6-13-20(16,2)19(17)12-14-21(15,18)3/h15-19H,4-14H2,1-3H3/t15-,16+,17-,18-,19-,20-,21+/m0/s1

InChIKey

InChIKey=JWMFYGXQPXQEEM-GCOKGBOCSA-N

SMILES

C[C@@]12[C@@]3([C@]([C@]4([C@](C)(CC3)[C@@H](CC)CC4)[H])(CC[C@]1(CCCC2)[H])[H])[H]

Canonical SMILES

CCC1CCC2C3CCC4CCCCC4(C)C3CCC12C

Other Names for this Substance

  • Pregnane, (5α)-
  • 5α-Pregnane
  • (5α)-Pregnane
  • Allopregnane

Deleted or Replaced CAS Registry Numbers

28904-23-6

CAS INSIGHTSTM
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