ChemSpider 2D Image | N-[4-(Heptyloxy)benzyl]-3,4-dimethylaniline | C22H31NO

N-[4-(Heptyloxy)benzyl]-3,4-dimethylaniline

  • Molecular FormulaC22H31NO
  • Average mass325.488 Da
  • Monoisotopic mass325.240570 Da
  • ChemSpider ID21330932

More details:

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

1040689-50-6 [RN]
Benzenemethanamine, N-(3,4-dimethylphenyl)-4-(heptyloxy)- [ACD/Index Name]
N-[4-(Heptyloxy)benzyl]-3,4-dimethylanilin [German] [ACD/IUPAC Name]
N-[4-(Heptyloxy)benzyl]-3,4-dimethylaniline [ACD/IUPAC Name]
N-[4-(Heptyloxy)benzyl]-3,4-diméthylaniline [French] [ACD/IUPAC Name]
N-{[4-(heptyloxy)phenyl]methyl}-3,4-dimethylaniline
MFCD10688166 [MDL number]
N-(4-(heptyloxy)benzyl)-3,4-dimethylaniline
N-[(4-heptoxyphenyl)methyl]-3,4-dimethylaniline

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

Density: 1.0±0.1 g/cm3
Boiling Point: 457.9±35.0 °C at 760 mmHg
Vapour Pressure: 0.0±1.1 mmHg at 25°C
Enthalpy of Vaporization: 71.8±3.0 kJ/mol
Flash Point: 201.4±15.4 °C
Index of Refraction: 1.556
Molar Refractivity: 104.5±0.3 cm3
#H bond acceptors: 2
#H bond donors: 1
#Freely Rotating Bonds: 10
#Rule of 5 Violations: 1
ACD/LogP: 7.15
ACD/LogD (pH 5.5): 7.08
ACD/BCF (pH 5.5): 138229.03
ACD/KOC (pH 5.5): 160735.36
ACD/LogD (pH 7.4): 7.14
ACD/BCF (pH 7.4): 155970.27
ACD/KOC (pH 7.4): 181365.20
Polar Surface Area: 21 Å2
Polarizability: 41.4±0.5 10-24cm3
Surface Tension: 38.3±3.0 dyne/cm
Molar Volume: 325.2±3.0 cm3

Click to predict properties on the Chemicalize site


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