ChemSpider 2D Image | 2-(2-isopropylanilino)pyridine-3-carboxylic acid | C15H16N2O2

2-(2-isopropylanilino)pyridine-3-carboxylic acid

  • Molecular FormulaC15H16N2O2
  • Average mass256.300 Da
  • Monoisotopic mass256.121185 Da
  • ChemSpider ID24258717

More details:

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

2-((2-Isopropylphenyl)amino)nicotinic acid
2-[2-(Propan-2-yl)anilino]pyridine-3-carboxylic acid
3-PYRIDINECARBOXYLIC ACID, 2-[[2-(1-METHYLETHYL)PHENYL]AMINO]-
55285-33-1 [RN]
MFCD12617774

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

Density: 1.2±0.1 g/cm3
Boiling Point: 391.4±37.0 °C at 760 mmHg
Vapour Pressure: 0.0±0.9 mmHg at 25°C
Enthalpy of Vaporization: 67.6±3.0 kJ/mol
Flash Point: 190.5±26.5 °C
Index of Refraction: 1.626
Molar Refractivity: 74.8±0.3 cm3
#H bond acceptors: 4
#H bond donors: 2
#Freely Rotating Bonds: 4
#Rule of 5 Violations: 1
ACD/LogP: 5.07
ACD/LogD (pH 5.5): 2.40
ACD/BCF (pH 5.5): 10.77
ACD/KOC (pH 5.5): 41.10
ACD/LogD (pH 7.4): 1.64
ACD/BCF (pH 7.4): 1.85
ACD/KOC (pH 7.4): 7.06
Polar Surface Area: 62 Å2
Polarizability: 29.7±0.5 10-24cm3
Surface Tension: 53.7±3.0 dyne/cm
Molar Volume: 211.3±3.0 cm3

Click to predict properties on the Chemicalize site


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