ChemSpider 2D Image | (4Z,6R,7R,11Z)-4-Ethylidene-7-hydroxy-6,7-dimethyl-14-(~2~H_3_)methyl-2,9-dioxa-14-azabicyclo[9.5.1]heptadec-11-ene-3,8,17-trione | C19H24D3NO6

(4Z,6R,7R,11Z)-4-Ethylidene-7-hydroxy-6,7-dimethyl-14-(2H3)methyl-2,9-dioxa-14-azabicyclo[9.5.1]heptadec-11-ene-3,8,17-trione

  • Molecular FormulaC19H24D3NO6
  • Average mass368.439 Da
  • Monoisotopic mass368.202667 Da
  • ChemSpider ID58783604

  • Double-bond stereo - Double-bond stereo

    defined stereocentres - 2 of 3 defined stereocentres

    Non-standard isotope - Non-standard isotope

More details:

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

(4Z,6R,7R,11Z)-4-Ethyliden-7-hydroxy-6,7-dimethyl-14-(2H3)methyl-2,9-dioxa-14-azabicyclo[9.5.1]heptadec-11-en-3,8,17-trion [German] [ACD/IUPAC Name]
(4Z,6R,7R,11Z)-4-Ethylidene-7-hydroxy-6,7-dimethyl-14-(2H3)methyl-2,9-dioxa-14-azabicyclo[9.5.1]heptadec-11-ene-3,8,17-trione [ACD/IUPAC Name]
(4Z,6R,7R,11Z)-4-Éthylidène-7-hydroxy-6,7-diméthyl-14-(2H3)méthyl-2,9-dioxa-14-azabicyclo[9.5.1]heptadéc-11-ène-3,8,17-trione [French] [ACD/IUPAC Name]
2,9-Dioxa-14-azabicyclo[9.5.1]heptadec-11-ene-3,8,17-trione, 4-ethylidene-7-hydroxy-6,7-dimethyl-14-(methyl-d3)-, (4Z,6R,7R,11Z)- [ACD/Index Name]

Predicted data is generated using the ACD/Labs Percepta Platform - PhysChem Module

Density: 1.2±0.1 g/cm3
Boiling Point: 604.9±55.0 °C at 760 mmHg
Vapour Pressure: 0.0±3.9 mmHg at 25°C
Enthalpy of Vaporization: 103.2±6.0 kJ/mol
Flash Point: 319.6±31.5 °C
Index of Refraction: 1.546
Molar Refractivity: 94.5±0.4 cm3
#H bond acceptors: 7
#H bond donors: 1
#Freely Rotating Bonds: 0
#Rule of 5 Violations: 0
ACD/LogP: 0.69
ACD/LogD (pH 5.5): 0.57
ACD/BCF (pH 5.5): 1.00
ACD/KOC (pH 5.5): 15.81
ACD/LogD (pH 7.4): 1.58
ACD/BCF (pH 7.4): 9.08
ACD/KOC (pH 7.4): 162.83
Polar Surface Area: 93 Å2
Polarizability: 37.5±0.5 10-24cm3
Surface Tension: 49.5±5.0 dyne/cm
Molar Volume: 298.4±5.0 cm3

Click to predict properties on the Chemicalize site


Advertisement