ChemSpider 2D Image | 4-Nitrobenzyl 4'-(10-undecen-1-yloxy)-4-biphenylcarboxylate | C31H35NO5

4-Nitrobenzyl 4'-(10-undecen-1-yloxy)-4-biphenylcarboxylate

  • Molecular FormulaC31H35NO5
  • Average mass501.613 Da
  • Monoisotopic mass501.251526 Da
  • ChemSpider ID555254

More details:

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

[1,1'-Biphenyl]-4-carboxylic acid, 4'-(10-undecen-1-yloxy)-, (4-nitrophenyl)methyl ester [ACD/Index Name]
[1,1'-biphenyl]-4-carboxylic acid, 4'-(10-undecenyloxy)-, (4-nitrophenyl)methyl ester
4'-(10-Undécén-1-yloxy)-4-biphénylcarboxylate de 4-nitrobenzyle [French] [ACD/IUPAC Name]
4-Nitrobenzyl 4'-(10-undecen-1-yloxy)-4-biphenylcarboxylate [ACD/IUPAC Name]
4-Nitrobenzyl 4'-(undec-10-en-1-yloxy)biphenyl-4-carboxylate
4-Nitrobenzyl-4'-(10-undecen-1-yloxy)-4-biphenylcarboxylat [German] [ACD/IUPAC Name]

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

Density: 1.1±0.1 g/cm3
Boiling Point: 641.3±50.0 °C at 760 mmHg
Vapour Pressure: 0.0±1.9 mmHg at 25°C
Enthalpy of Vaporization: 94.7±3.0 kJ/mol
Flash Point: 217.9±32.1 °C
Index of Refraction: 1.565
Molar Refractivity: 146.4±0.3 cm3
#H bond acceptors: 6
#H bond donors: 0
#Freely Rotating Bonds: 17
#Rule of 5 Violations: 2
ACD/LogP: 9.97
ACD/LogD (pH 5.5): 8.81
ACD/BCF (pH 5.5): 1000000.00
ACD/KOC (pH 5.5): 1479875.38
ACD/LogD (pH 7.4): 8.81
ACD/BCF (pH 7.4): 1000000.00
ACD/KOC (pH 7.4): 1479875.38
Polar Surface Area: 81 Å2
Polarizability: 58.0±0.5 10-24cm3
Surface Tension: 43.9±3.0 dyne/cm
Molar Volume: 449.3±3.0 cm3

Click to predict properties on the Chemicalize site


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