ChemSpider 2D Image | (2S,3alpha,17beta)-(2-~3~H_1_)Estr-4-ene-3,17-diyl diacetate | C22H31TO4

(2S,3α,17β)-(2-3H1)Estr-4-ene-3,17-diyl diacetate

  • Molecular FormulaC22H31TO4
  • Average mass362.495 Da
  • Monoisotopic mass362.238281 Da
  • ChemSpider ID2339096

  • defined stereocentres - 7 of 7 defined stereocentres

    Non-standard isotope - Non-standard isotope

More details:

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

(2S,3α,17β)-(2-3H1)Estr-4-en-3,17-diyl-diacetat [German] [ACD/IUPAC Name]
(2S,3α,17β)-(2-3H1)Estr-4-ene-3,17-diyl diacetate [ACD/IUPAC Name]
Diacétate de (2S,3α,17β)-(2-3H1)estr-4-ène-3,17-diyle [French] [ACD/IUPAC Name]
Estr-4-ene-2-t-3,17-diol, diacetate, (2S,3α,17β)- [ACD/Index Name]
3β,17β-Diacetoxy-4-estrene
51154-02-0 [RN]
Estr-4-ene-2-t-3,17-diol, diacetate, (2β,3β,17β)-

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

Density:
Boiling Point: 446.5±45.0 °C at 760 mmHg
Vapour Pressure: 0.0±1.1 mmHg at 25°C
Enthalpy of Vaporization: 70.5±3.0 kJ/mol
Flash Point: 215.6±27.1 °C
Index of Refraction:
Molar Refractivity:
#H bond acceptors: 4
#H bond donors: 0
#Freely Rotating Bonds: 4
#Rule of 5 Violations: 1
ACD/LogP: 5.34
ACD/LogD (pH 5.5): 5.01
ACD/BCF (pH 5.5): 3790.94
ACD/KOC (pH 5.5): 12684.14
ACD/LogD (pH 7.4): 5.01
ACD/BCF (pH 7.4): 3790.94
ACD/KOC (pH 7.4): 12684.14
Polar Surface Area: 53 Å2
Polarizability:
Surface Tension:
Molar Volume:

Click to predict properties on the Chemicalize site


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