ChemSpider 2D Image | 4-[(Z)-({[(4,5-Diphenyl-4H-1,2,4-triazol-3-yl)sulfanyl]acetyl}hydrazono)methyl]-2,6-dimethylphenyl 2,5,8,11,14,17,20,23-octaoxahexacosan-26-oate | C43H57N5O11S

4-[(Z)-({[(4,5-Diphenyl-4H-1,2,4-triazol-3-yl)sulfanyl]acetyl}hydrazono)methyl]-2,6-dimethylphenyl 2,5,8,11,14,17,20,23-octaoxahexacosan-26-oate

  • Molecular FormulaC43H57N5O11S
  • Average mass852.005 Da
  • Monoisotopic mass851.377502 Da
  • ChemSpider ID99516050

  • Double-bond stereo - Double-bond stereo

More details:

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

2,5,8,11,14,17,20,23-Octaoxahexacosan-26-oate de 4-[(Z)-({2-[(4,5-diphényl-4H-1,2,4-triazol-3-yl)sulfanyl]acétyl}hydrazono)méthyl]-2,6-diméthylphényle [French] [ACD/IUPAC Name]
2,5,8,11,14,17,20,23-Octaoxahexacosan-26-oic acid, 4-[(Z)-[2-[2-[(4,5-diphenyl-4H-1,2,4-triazol-3-yl)thio]acetyl]hydrazinylidene]methyl]-2,6-dimethylphenyl ester [ACD/Index Name]
4-[(Z)-({[(4,5-Diphenyl-4H-1,2,4-triazol-3-yl)sulfanyl]acetyl}hydrazono)methyl]-2,6-dimethylphenyl 2,5,8,11,14,17,20,23-octaoxahexacosan-26-oate [ACD/IUPAC Name]
4-[(Z)-({[(4,5-Diphenyl-4H-1,2,4-triazol-3-yl)sulfanyl]acetyl}hydrazono)methyl]-2,6-dimethylphenyl-2,5,8,11,14,17,20,23-octaoxahexacosan-26-oat [German] [ACD/IUPAC Name]

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

Density: 1.2±0.1 g/cm3
Boiling Point:
Vapour Pressure:
Enthalpy of Vaporization:
Flash Point:
Index of Refraction: 1.563
Molar Refractivity: 228.2±0.5 cm3
#H bond acceptors: 16
#H bond donors: 1
#Freely Rotating Bonds: 33
#Rule of 5 Violations: 2
ACD/LogP: 4.93
ACD/LogD (pH 5.5): 3.86
ACD/BCF (pH 5.5): 507.40
ACD/KOC (pH 5.5): 3006.69
ACD/LogD (pH 7.4): 3.86
ACD/BCF (pH 7.4): 507.34
ACD/KOC (pH 7.4): 3006.37
Polar Surface Area: 198 Å2
Polarizability: 90.5±0.5 10-24cm3
Surface Tension: 44.9±7.0 dyne/cm
Molar Volume: 702.8±7.0 cm3

Click to predict properties on the Chemicalize site


Advertisement