Found 73 results

Search term: MF = 'C_{31}H_{53}NO_{4}'
ChemSpider 2D Image | (4alpha,5alpha,6alpha,10alpha,13alpha,14beta,17alpha)-4-Acetamido-5-hydroxycholestan-6-yl acetate | C31H53NO4

(4α,5α,6α,10α,13α,14β,17α)-4-Acetamido-5-hydroxycholestan-6-yl acetate

  • Molecular FormulaC31H53NO4
  • Average mass503.757 Da
  • Monoisotopic mass503.397461 Da
  • ChemSpider ID62527353

  • defined stereocentres - 10 of 10 defined stereocentres

More details:

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

(4α,5α,6α,10α,13α,14β,17α)-4-Acetamido-5-hydroxycholestan-6-yl acetate [ACD/IUPAC Name]
(4α,5α,6α,10α,13α,14β,17α)-4-Acetamido-5-hydroxycholestan-6-yl-acetat [German] [ACD/IUPAC Name]
(4β,5α,6β,8α,9β,10α,13α,14β)-4-Acetamido-5-hydroxycholestan-6-yl acetate [ACD/IUPAC Name]
(4β,5α,6β,8α,9β,10α,13α,14β)-4-Acetamido-5-hydroxycholestan-6-yl-acetat [German] [ACD/IUPAC Name]
Acetamide, N-[(4α,5α,6α,10α,13α,14β,17α)-6-(acetyloxy)-5-hydroxycholestan-4-yl]- [ACD/Index Name]
Acetamide, N-[(4β,5α,6β,8α,9β,10α,13α,14β)-6-(acetyloxy)-5-hydroxycholestan-4-yl]- [ACD/Index Name]
Acétate de (4α,5α,6α,10α,13α,14β,17α)-4-acétamido-5-hydroxycholestan-6-yle [French] [ACD/IUPAC Name]
Acétate de (4β,5α,6β,8α,9β,10α,13α,14β)-4-acétamido-5-hydroxycholestan-6-yle [French] [ACD/IUPAC Name]

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

Density: 1.1±0.1 g/cm3
Boiling Point: 603.5±48.0 °C at 760 mmHg
Vapour Pressure: 0.0±3.9 mmHg at 25°C
Enthalpy of Vaporization: 103.0±6.0 kJ/mol
Flash Point: 318.8±29.6 °C
Index of Refraction: 1.526
Molar Refractivity: 144.4±0.4 cm3
#H bond acceptors: 5
#H bond donors: 2
#Freely Rotating Bonds: 8
#Rule of 5 Violations: 2
ACD/LogP: 7.65
ACD/LogD (pH 5.5): 6.64
ACD/BCF (pH 5.5): 65058.20
ACD/KOC (pH 5.5): 97038.21
ACD/LogD (pH 7.4): 6.64
ACD/BCF (pH 7.4): 65058.20
ACD/KOC (pH 7.4): 97038.21
Polar Surface Area: 76 Å2
Polarizability: 57.3±0.5 10-24cm3
Surface Tension: 42.6±5.0 dyne/cm
Molar Volume: 470.8±5.0 cm3

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