ChemSpider 2D Image | 3-Chloro-2-methyl-N-[2-(2-methylphenyl)ethyl]aniline | C16H18ClN

3-Chloro-2-methyl-N-[2-(2-methylphenyl)ethyl]aniline

  • Molecular FormulaC16H18ClN
  • Average mass259.774 Da
  • Monoisotopic mass259.112762 Da
  • ChemSpider ID21330398

More details:

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

1040688-34-3 [RN]
3-Chlor-2-methyl-N-[2-(2-methylphenyl)ethyl]anilin [German] [ACD/IUPAC Name]
3-Chloro-2-methyl-N-[2-(2-methylphenyl)ethyl]aniline [ACD/IUPAC Name]
3-Chloro-2-méthyl-N-[2-(2-méthylphényl)éthyl]aniline [French] [ACD/IUPAC Name]
Benzeneethanamine, N-(3-chloro-2-methylphenyl)-2-methyl- [ACD/Index Name]
(3-chloro-2-methylphenyl)[2-(2-methylphenyl)ethyl]amine
3-Chloro-2-methyl-N-(2-methylphenethyl)aniline
MFCD10687630 [MDL number]

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

Density: 1.1±0.1 g/cm3
Boiling Point: 418.6±33.0 °C at 760 mmHg
Vapour Pressure: 0.0±1.0 mmHg at 25°C
Enthalpy of Vaporization: 67.2±3.0 kJ/mol
Flash Point: 207.0±25.4 °C
Index of Refraction: 1.606
Molar Refractivity: 79.5±0.3 cm3
#H bond acceptors: 1
#H bond donors: 1
#Freely Rotating Bonds: 4
#Rule of 5 Violations: 1
ACD/LogP: 5.74
ACD/LogD (pH 5.5): 5.30
ACD/BCF (pH 5.5): 6269.76
ACD/KOC (pH 5.5): 18055.52
ACD/LogD (pH 7.4): 5.31
ACD/BCF (pH 7.4): 6424.80
ACD/KOC (pH 7.4): 18502.00
Polar Surface Area: 12 Å2
Polarizability: 31.5±0.5 10-24cm3
Surface Tension: 42.6±3.0 dyne/cm
Molar Volume: 230.6±3.0 cm3

Click to predict properties on the Chemicalize site


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