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ChemSpider 2D Image | N-(2-Chlorobenzyl)-2-isopropylaniline | C16H18ClN

N-(2-Chlorobenzyl)-2-isopropylaniline

  • Molecular FormulaC16H18ClN
  • Average mass259.774 Da
  • Monoisotopic mass259.112762 Da
  • ChemSpider ID21330792

More details:

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

1040027-21-1 [RN]
Benzenemethanamine, 2-chloro-N-[2-(1-methylethyl)phenyl]- [ACD/Index Name]
N-(2-Chlorbenzyl)-2-isopropylanilin [German] [ACD/IUPAC Name]
N-(2-Chlorobenzyl)-2-isopropylaniline [ACD/IUPAC Name]
N-(2-Chlorobenzyl)-2-isopropylaniline [French] [ACD/IUPAC Name]
N-[(2-chlorophenyl)methyl]-2-(propan-2-yl)aniline
N-[(2-chlorophenyl)methyl]-2-isopropylaniline
(2-chlorobenzyl)(2-isopropylphenyl)amine
MFCD10688031 [MDL number]
N-[(2-chlorophenyl)methyl]-2-propan-2-ylaniline

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

Density: 1.1±0.1 g/cm3
Boiling Point: 369.1±30.0 °C at 760 mmHg
Vapour Pressure: 0.0±0.8 mmHg at 25°C
Enthalpy of Vaporization: 61.6±3.0 kJ/mol
Flash Point: 177.0±24.6 °C
Index of Refraction: 1.602
Molar Refractivity: 79.4±0.3 cm3
#H bond acceptors: 1
#H bond donors: 1
#Freely Rotating Bonds: 4
#Rule of 5 Violations: 1
ACD/LogP: 5.06
ACD/LogD (pH 5.5): 4.79
ACD/BCF (pH 5.5): 2586.75
ACD/KOC (pH 5.5): 9627.84
ACD/LogD (pH 7.4): 4.80
ACD/BCF (pH 7.4): 2605.76
ACD/KOC (pH 7.4): 9698.63
Polar Surface Area: 12 Å2
Polarizability: 31.5±0.5 10-24cm3
Surface Tension: 41.9±3.0 dyne/cm
Molar Volume: 231.6±3.0 cm3

Click to predict properties on the Chemicalize site


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