ChemSpider 2D Image | 2-Acetamido-5-(4-Phenylphenyl)benzoic Acid | C21H17NO3

2-Acetamido-5-(4-Phenylphenyl)benzoic Acid

  • Molecular FormulaC21H17NO3
  • Average mass331.365 Da
  • Monoisotopic mass331.120850 Da
  • ChemSpider ID25058633

More details:

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

[1,1':4',1''-Terphenyl]-3-carboxylic acid, 4-(acetylamino)- [ACD/Index Name]
2-Acetamido-5-(4-Phenylphenyl)benzoic Acid
4-Acetamido-1,1':4',1''-terphenyl-3-carbonsäure [German] [ACD/IUPAC Name]
4-Acetamido-1,1':4',1''-terphenyl-3-carboxylic acid [ACD/IUPAC Name]
Acide 4-acétamido-1,1':4',1''-terphényl-3-carboxylique [French] [ACD/IUPAC Name]
VGN

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

Density: 1.2±0.1 g/cm3
Boiling Point: 618.6±55.0 °C at 760 mmHg
Vapour Pressure: 0.0±1.9 mmHg at 25°C
Enthalpy of Vaporization: 96.4±3.0 kJ/mol
Flash Point: 327.9±31.5 °C
Index of Refraction: 1.648
Molar Refractivity: 96.6±0.3 cm3
#H bond acceptors: 4
#H bond donors: 2
#Freely Rotating Bonds: 4
#Rule of 5 Violations: 1
ACD/LogP: 5.78
ACD/LogD (pH 5.5): 3.19
ACD/BCF (pH 5.5): 54.21
ACD/KOC (pH 5.5): 172.46
ACD/LogD (pH 7.4): 2.04
ACD/BCF (pH 7.4): 3.85
ACD/KOC (pH 7.4): 12.26
Polar Surface Area: 66 Å2
Polarizability: 38.3±0.5 10-24cm3
Surface Tension: 53.9±3.0 dyne/cm
Molar Volume: 265.6±3.0 cm3

Click to predict properties on the Chemicalize site


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