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Substance Name: 6alpha-Methyl-11-oxoprogesterone
RN: 3642-85-1
UNII: 4P9MHB40VF
InChIKey: NUSUWEUUEXDJDY-CMYFSFSVSA-N

Molecular Formula

  • C22-H30-O3

Molecular Weight

  • 342.476
 
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Names and Synonyms

Results Name

  • 6alpha-Methyl-11-oxoprogesterone

Name of Substance

  • NSC-17256

Synonyms

  • 6alpha-Methyl-11-oxoprogesterone
  • 6alpha-Methylpregn-4-ene-3,11,20-trione
  • FDA 0070
  • NSC 17256
  • Progesterone, 6alpha-methyl-11-oxo-
  • SKI 22936
  • U 7654
  • UNII-4P9MHB40VF

Systematic Names

  • Pregn-4-ene-3,11,20-trione, 6-methyl-, (6alpha)- (9CI)
  • Pregn-4-ene-3,11,20-trione, 6alpha-methyl- (8CI)

Registry Numbers

CAS Registry Number

  • 3642-85-1

FDA UNII

  • 4P9MHB40VF

System Generated Number

  • 0003642851

Structure Descriptors

InChI

1S/C22H30O3/c1-12-9-15-17-6-5-16(13(2)23)22(17,4)11-19(25)20(15)21(3)8-7-14(24)10-18(12)21/h10,12,15-17,20H,5-9,11H2,1-4H3/t12-,15-,16+,17-,20+,21-,22+/m0/s1

InChIKey

NUSUWEUUEXDJDY-CMYFSFSVSA-N

Smiles

C[C@H]1C[C@H]2[C@@H]3CC[C@@H]([C@]3(CC(=O)[C@@H]2[C@@]4(C1=CC(=O)CC4)C)C)C(=O)C

Physical Properties

Physical Property Value Units Temp (deg C) Source
log P (octanol-water) 2.75 (none)   EXP
Water Solubility 30.8 mg/L 25 EST
Vapor Pressure 5.99E-08 mm Hg 25 EST
Henry's Law Constant 3.29E-11 atm-m3/mole 25 EST
Atmospheric OH Rate Constant 1.10E-10 cm3/molecule-sec 25 EST

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