ChemSpider 2D Image | 2-(4-Chloro-2,5-dimethoxyphenyl)-N-(3-methoxybenzyl)ethanamine | C18H22ClNO3

2-(4-Chloro-2,5-dimethoxyphenyl)-N-(3-methoxybenzyl)ethanamine

  • Molecular FormulaC18H22ClNO3
  • Average mass335.825 Da
  • Monoisotopic mass335.128815 Da
  • ChemSpider ID52085462

More details:






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

1566571-34-3 [RN]
2-(4-Chlor-2,5-dimethoxyphenyl)-N-(3-methoxybenzyl)ethanamin [German] [ACD/IUPAC Name]
2-(4-Chloro-2,5-dimethoxyphenyl)-N-(3-methoxybenzyl)ethanamine [ACD/IUPAC Name]
2-(4-Chloro-2,5-diméthoxyphényl)-N-(3-méthoxybenzyl)éthanamine [French] [ACD/IUPAC Name]
4-CHLORO-2,5-DIMETHOXY-N-((3-METHOXYPHENYL)METHYL)-BENZENEETHANAMINE
Benzeneethanamine, 4-chloro-2,5-dimethoxy-N-[(3-methoxyphenyl)methyl]- [ACD/Index Name]

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

6NH04YN8AH [DBID]
UNII:6NH04YN8AH [DBID]

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

Density: 1.1±0.1 g/cm3
Boiling Point: 458.8±40.0 °C at 760 mmHg
Vapour Pressure: 0.0±1.1 mmHg at 25°C
Enthalpy of Vaporization: 71.9±3.0 kJ/mol
Flash Point: 231.3±27.3 °C
Index of Refraction: 1.553
Molar Refractivity: 93.4±0.3 cm3
#H bond acceptors: 4
#H bond donors: 1
#Freely Rotating Bonds: 8
#Rule of 5 Violations: 0
ACD/LogP: 4.15
ACD/LogD (pH 5.5): 1.47
ACD/BCF (pH 5.5): 1.55
ACD/KOC (pH 5.5): 7.16
ACD/LogD (pH 7.4): 2.93
ACD/BCF (pH 7.4): 45.11
ACD/KOC (pH 7.4): 207.85
Polar Surface Area: 40 Å2
Polarizability: 37.0±0.5 10-24cm3
Surface Tension: 38.9±3.0 dyne/cm
Molar Volume: 292.2±3.0 cm3

Click to predict properties on the Chemicalize site






Advertisement