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Substance Name: (3alpha,5alpha)-Androst-16-en-3-ol
RN: 1153-51-1
UNII: 48K9VAM062
InChIKey: KRVXMNNRSSQZJP-PHFHYRSDSA-N

Classification Code

  • TSCA Flag P (a Commenced PMN (Premanufacture Notice) Substance)

Molecular Formula

  • C19-H30-O

Molecular Weight

  • 274.445
 
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Names and Synonyms

Name of Substance

  • (3alpha,5alpha)-Androst-16-en-3-ol
  • Androst-16-en-3-ol

Synonyms

  • 3alpha-Hydroxyandrost-16-ene
  • EINECS 214-573-1
  • NSC 71076
  • UNII-48K9VAM062

Systematic Names

  • 5alpha-Androst-16-en-3alpha-ol
  • Androst-16-en-3-ol, (3alpha,5alpha)-
  • Androst-16-en-3-ol, (3alpha,5alpha)- (9CI)

Registry Numbers

CAS Registry Number

  • 1153-51-1

FDA UNII

  • 48K9VAM062

System Generated Number

  • 0001153511

Structure Descriptors

InChI

1S/C19H30O/c1-18-9-3-4-16(18)15-6-5-13-12-14(20)7-11-19(13,2)17(15)8-10-18/h3,9,13-17,20H,4-8,10-12H2,1-2H3/t13-,14+,15-,16-,17-,18-,19-/m0/s1

InChIKey

KRVXMNNRSSQZJP-PHFHYRSDSA-N

Smiles

C=1[C@@]2([C@H]([C@@H]3CC[C@H]4C[C@@H](CC[C@@]4([C@H]3CC2)C)O)CC1)C

Physical Properties

Physical Property Value Units Temp (deg C) Source
Melting Point 142.75 deg C   EXP
log P (octanol-water) 4.900 (none)   EST
Atmospheric OH Rate Constant 9.09E-11 cm3/molecule-sec 25 EST

Physical property data is provided to ChemIDplus by SRC, Inc.