Found 82 results

Search term: MF = 'C_{31}H_{47}NO_{4}'
ChemSpider 2D Image | (3alpha,9beta,13alpha,16beta,25R)-26-Acetamidofurosta-5,20(22)-dien-3-yl acetate | C31H47NO4

(3α,9β,13α,16β,25R)-26-Acetamidofurosta-5,20(22)-dien-3-yl acetate

  • Molecular FormulaC31H47NO4
  • Average mass497.709 Da
  • Monoisotopic mass497.350494 Da
  • ChemSpider ID62685257

  • defined stereocentres - 9 of 9 defined stereocentres

More details:

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

(3α,9β,13α,16β,25R)-26-Acetamidofurosta-5,20(22)-dien-3-yl acetate [ACD/IUPAC Name]
(3α,9β,13α,16β,25R)-26-Acetamidofurosta-5,20(22)-dien-3-yl-acetat [German] [ACD/IUPAC Name]
(3β,8α,9β,10α,13α,17β,25R)-26-Acetamidofurosta-5,20(22)-dien-3-yl acetate [ACD/IUPAC Name]
(3β,8α,9β,10α,13α,17β,25R)-26-Acetamidofurosta-5,20(22)-dien-3-yl-acetat [German] [ACD/IUPAC Name]
Acetamide, N-[(3α,9β,13α,16β,25R)-3-(acetyloxy)furosta-5,20(22)-dien-27-yl]- [ACD/Index Name]
Acetamide, N-[(3β,8α,9β,10α,13α,17β,25R)-3-(acetyloxy)furosta-5,20(22)-dien-27-yl]- [ACD/Index Name]
Acétate de (3α,9β,13α,16β,25R)-26-acétamidofurosta-5,20(22)-dién-3-yle [French] [ACD/IUPAC Name]
Acétate de (3β,8α,9β,10α,13α,17β,25R)-26-acétamidofurosta-5,20(22)-dién-3-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: 629.9±55.0 °C at 760 mmHg
Vapour Pressure: 0.0±1.8 mmHg at 25°C
Enthalpy of Vaporization: 93.2±3.0 kJ/mol
Flash Point: 334.8±31.5 °C
Index of Refraction: 1.549
Molar Refractivity: 141.7±0.4 cm3
#H bond acceptors: 5
#H bond donors: 1
#Freely Rotating Bonds: 7
#Rule of 5 Violations: 1
ACD/LogP: 6.40
ACD/LogD (pH 5.5): 6.36
ACD/BCF (pH 5.5): 40282.85
ACD/KOC (pH 5.5): 68853.78
ACD/LogD (pH 7.4): 6.36
ACD/BCF (pH 7.4): 40282.89
ACD/KOC (pH 7.4): 68853.86
Polar Surface Area: 65 Å2
Polarizability: 56.2±0.5 10-24cm3
Surface Tension: 43.7±5.0 dyne/cm
Molar Volume: 445.9±5.0 cm3

Click to predict properties on the Chemicalize site


Advertisement