(5α,17β)-17-Hydroxyandrost-2-ene-2-carbonitrile

CAS Registry Number®

1093-60-3
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CAS Name

(5α,17β)-17-Hydroxyandrost-2-ene-2-carbonitrile

Molecular Formula

C20H29NO

Molecular Mass

299.45

Cite this Page

(5α,17β)-17-Hydroxyandrost-2-ene-2-carbonitrile.   CAS Common Chemistry.   CAS, a division of the American Chemical Society, n.d.   http://commonchemistry.cas.org/detail?cas_rn=1093-60-3 (retrieved 2024-09-22) (CAS RN: 1093-60-3).  Licensed under the Attribution-Noncommercial 4.0 International License (CC BY-NC 4.0).

Compound Properties

  • Melting Point (1)

    150-152 °C

Source(s)

Other Names and Identifiers

InChI

InChI=1S/C20H29NO/c1-19-10-9-17-15(16(19)7-8-18(19)22)6-5-14-4-3-13(12-21)11-20(14,17)2/h3,14-18,22H,4-11H2,1-2H3/t14-,15+,16+,17+,18+,19+,20+/m1/s1

InChIKey

InChIKey=WAYOXMHWDMAJDN-WDCLZLQXSA-N

SMILES

C[C@@]12[C@@]3([C@]([C@]4([C@](C)(CC3)[C@@H](O)CC4)[H])(CC[C@]1(CC=C(C#N)C2)[H])[H])[H]

Canonical SMILES

N#CC1=CCC2CCC3C4CCC(O)C4(C)CCC3C2(C)C1

Other Names for this Substance

  • Androst-2-ene-2-carbonitrile, 17-hydroxy-, (5α,17β)-
  • 5α-Androst-2-ene-2-carbonitrile, 17β-hydroxy-
  • (5α,17β)-17-Hydroxyandrost-2-ene-2-carbonitrile