ChemSpider 2D Image | ABIRATERONE SULFATE | C24H31NO4S

ABIRATERONE SULFATE

  • Molecular FormulaC24H31NO4S
  • Average mass429.572 Da
  • Monoisotopic mass429.197388 Da
  • ChemSpider ID52083975
  • defined stereocentres - 6 of 6 defined stereocentres


More details:






Validated by Experts, Validated by Users, Non-Validated, Removed by Users

(3β)-17-(3-Pyridinyl)androsta-5,16-dien-3-yl hydrogen sulfate [ACD/IUPAC Name]
(3β)-17-(3-Pyridinyl)androsta-5,16-dien-3-ylhydrogensulfat [German] [ACD/IUPAC Name]
ABIRATERONE SULFATE
Androsta-5,16-dien-3-ol, 17-(3-pyridinyl)-, hydrogen sulfate (ester), (3β)- [ACD/Index Name]
Hydrogénosulfate de (3β)-17-(3-pyridinyl)androsta-5,16-dién-3-yle [French] [ACD/IUPAC Name]
1993430-25-3 [RN]

Validated by Experts, Validated by Users, Non-Validated, Removed by Users

WZ5U45K71V [DBID]
UNII:WZ5U45K71V [DBID]

Predicted data is generated using the ACD/Labs Percepta Platform - PhysChem Module, version: 14.00

Density: 1.3±0.1 g/cm3
Boiling Point:
Vapour Pressure:
Enthalpy of Vaporization:
Flash Point:
Index of Refraction: 1.618
Molar Refractivity: 115.8±0.4 cm3
#H bond acceptors: 5
#H bond donors: 1
#Freely Rotating Bonds: 3
#Rule of 5 Violations: 1
ACD/LogP: 5.99
ACD/LogD (pH 5.5): 1.33
ACD/BCF (pH 5.5): 1.24
ACD/KOC (pH 5.5): 6.33
ACD/LogD (pH 7.4): 0.70
ACD/BCF (pH 7.4): 1.00
ACD/KOC (pH 7.4): 1.50
Polar Surface Area: 85 Å2
Polarizability: 45.9±0.5 10-24cm3
Surface Tension: 58.1±5.0 dyne/cm
Molar Volume: 330.2±5.0 cm3

Click to predict properties on the Chemicalize site






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