ChemSpider 2D Image | (3E,13E)-4,13-Bis(2-hydroxy-5-methoxyphenyl)-1,16-diphenyl-2,15-dioxa-3,14-diazahexadeca-3,13-diene-1,16-dione | C38H40N2O8

(3E,13E)-4,13-Bis(2-hydroxy-5-methoxyphenyl)-1,16-diphenyl-2,15-dioxa-3,14-diazahexadeca-3,13-diene-1,16-dione

  • Molecular FormulaC38H40N2O8
  • Average mass652.733 Da
  • Monoisotopic mass652.278442 Da
  • ChemSpider ID17970594

  • Double-bond stereo - Double-bond stereo

More details:

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

(3E,13E)-4,13-Bis(2-hydroxy-5-methoxyphenyl)-1,16-diphenyl-2,15-dioxa-3,14-diazahexadeca-3,13-dien-1,16-dion [German] [ACD/IUPAC Name]
(3E,13E)-4,13-Bis(2-hydroxy-5-methoxyphenyl)-1,16-diphenyl-2,15-dioxa-3,14-diazahexadeca-3,13-diene-1,16-dione [ACD/IUPAC Name]
(3E,13E)-4,13-Bis(2-hydroxy-5-méthoxyphényl)-1,16-diphényl-2,15-dioxa-3,14-diazahexadéca-3,13-diène-1,16-dione [French] [ACD/IUPAC Name]
2,15-Dioxa-3,14-diazahexadeca-3,13-diene-1,16-dione, 4,13-bis(2-hydroxy-5-methoxyphenyl)-1,16-diphenyl-, (3E,13E)- [ACD/Index Name]
(1E,11E)-2,11-bis(2-hydroxy-5-methoxyphenyl)-12-phenylcarbonyloxy-1,12-diazadodeca-1,11-dienyl benzoate

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

Density: 1.2±0.1 g/cm3
Boiling Point: 795.0±70.0 °C at 760 mmHg
Vapour Pressure: 0.0±2.9 mmHg at 25°C
Enthalpy of Vaporization: 119.6±3.0 kJ/mol
Flash Point: 434.6±35.7 °C
Index of Refraction: 1.575
Molar Refractivity: 182.2±0.5 cm3
#H bond acceptors: 10
#H bond donors: 2
#Freely Rotating Bonds: 19
#Rule of 5 Violations: 3
ACD/LogP: 10.35
ACD/LogD (pH 5.5): 9.14
ACD/BCF (pH 5.5): 1000000.00
ACD/KOC (pH 5.5): 2237150.50
ACD/LogD (pH 7.4): 9.07
ACD/BCF (pH 7.4): 1000000.00
ACD/KOC (pH 7.4): 1895056.75
Polar Surface Area: 136 Å2
Polarizability: 72.2±0.5 10-24cm3
Surface Tension: 44.7±7.0 dyne/cm
Molar Volume: 551.6±7.0 cm3

Click to predict properties on the Chemicalize site


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