ChemSpider 2D Image | N-{(E)-[4-(Allyloxy)-3-methoxyphenyl]methylene}-2-{[(3,4-dimethoxyphenyl)sulfonyl](4-methoxyphenyl)amino}ethanehydrazonic acid | C28H31N3O8S

N-{(E)-[4-(Allyloxy)-3-methoxyphenyl]methylene}-2-{[(3,4-dimethoxyphenyl)sulfonyl](4-methoxyphenyl)amino}ethanehydrazonic acid

  • Molecular FormulaC28H31N3O8S
  • Average mass569.626 Da
  • Monoisotopic mass569.183167 Da
  • ChemSpider ID57319744

  • Double-bond stereo - Double-bond stereo

More details:

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

Acide N-{(E)-[4-(allyloxy)-3-méthoxyphényl]méthylène}-2-{[(3,4-diméthoxyphényl)sulfonyl](4-méthoxyphényl)amino}éthanehydrazonique [French] [ACD/IUPAC Name]
Ethanehydrazonic acid, 2-[[(3,4-dimethoxyphenyl)sulfonyl](4-methoxyphenyl)amino]-N-[(1E)-[3-methoxy-4-(2-propen-1-yloxy)phenyl]methylene]- [ACD/Index Name]
N-{(E)-[4-(Allyloxy)-3-methoxyphenyl]methylen}-2-{[(3,4-dimethoxyphenyl)sulfonyl](4-methoxyphenyl)amino}ethanhydrazonsäure [German] [ACD/IUPAC Name]
N-{(E)-[4-(Allyloxy)-3-methoxyphenyl]methylene}-2-{[(3,4-dimethoxyphenyl)sulfonyl](4-methoxyphenyl)amino}ethanehydrazonic acid [ACD/IUPAC Name]
2-(N-(3,4-DIMETHOXYPHENYL)SULFONYL-4-METHOXYANILINO)-N-[(E)-(3-METHOXY-4-PROP-2-ENOXYPHENYL)METHYLIDENEAMINO]ACETAMIDE

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

Density: 1.2±0.1 g/cm3
Boiling Point: 741.3±70.0 °C at 760 mmHg
Vapour Pressure: 0.0±2.6 mmHg at 25°C
Enthalpy of Vaporization: 113.5±3.0 kJ/mol
Flash Point: 402.2±35.7 °C
Index of Refraction: 1.564
Molar Refractivity: 150.6±0.5 cm3
#H bond acceptors: 11
#H bond donors: 1
#Freely Rotating Bonds: 14
#Rule of 5 Violations: 2
ACD/LogP: 4.67
ACD/LogD (pH 5.5): 2.56
ACD/BCF (pH 5.5): 24.55
ACD/KOC (pH 5.5): 140.53
ACD/LogD (pH 7.4): 2.59
ACD/BCF (pH 7.4): 26.32
ACD/KOC (pH 7.4): 150.68
Polar Surface Area: 137 Å2
Polarizability: 59.7±0.5 10-24cm3
Surface Tension: 43.6±7.0 dyne/cm
Molar Volume: 462.9±7.0 cm3

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