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Search term: WMBHNJXBHHHZFG-UHFFFAOYSA-N (Found by InChIKey (full match))
ChemSpider 2D Image | 2-(4-{[4-(2-Methyl-2-propanyl)phenyl]carbamoyl}phenyl)nicotinic acid | C23H22N2O3

2-(4-{[4-(2-Methyl-2-propanyl)phenyl]carbamoyl}phenyl)nicotinic acid

  • Molecular FormulaC23H22N2O3
  • Average mass374.432 Da
  • Monoisotopic mass374.163055 Da
  • ChemSpider ID23276198

More details:

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

2-(4-{[4-(2-Methyl-2-propanyl)phenyl]carbamoyl}phenyl)nicotinic acid [ACD/IUPAC Name]
2-(4-{[4-(2-Methyl-2-propanyl)phenyl]carbamoyl}phenyl)nicotinsäure [German] [ACD/IUPAC Name]
2-{4-[(4-tert-butylphenyl)carbamoyl]phenyl}pyridine-3-carboxylic acid
3-Pyridinecarboxylic acid, 2-[4-[[[4-(1,1-dimethylethyl)phenyl]amino]carbonyl]phenyl]- [ACD/Index Name]
Acide 2-(4-{[4-(2-méthyl-2-propanyl)phényl]carbamoyl}phényl)nicotinique [French] [ACD/IUPAC Name]
2-(4-((4-tert-butylphenyl)carbamoyl)phenyl)nicotinic acid
CHEMBL215433

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

Density: 1.2±0.1 g/cm3
Boiling Point: 486.3±45.0 °C at 760 mmHg
Vapour Pressure: 0.0±1.3 mmHg at 25°C
Enthalpy of Vaporization: 79.2±3.0 kJ/mol
Flash Point: 247.9±28.7 °C
Index of Refraction: 1.630
Molar Refractivity: 108.8±0.3 cm3
#H bond acceptors: 5
#H bond donors: 2
#Freely Rotating Bonds: 5
#Rule of 5 Violations: 0
ACD/LogP: 3.38
ACD/LogD (pH 5.5): 1.97
ACD/BCF (pH 5.5): 5.66
ACD/KOC (pH 5.5): 29.43
ACD/LogD (pH 7.4): 1.02
ACD/BCF (pH 7.4): 1.00
ACD/KOC (pH 7.4): 3.32
Polar Surface Area: 79 Å2
Polarizability: 43.1±0.5 10-24cm3
Surface Tension: 52.7±3.0 dyne/cm
Molar Volume: 306.0±3.0 cm3

Click to predict properties on the Chemicalize site


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