ChemSpider 2D Image | N-[1-(3-Bromophenyl)-2-propanyl]-3-phenyl-1-propanamine | C18H22BrN

N-[1-(3-Bromophenyl)-2-propanyl]-3-phenyl-1-propanamine

  • Molecular FormulaC18H22BrN
  • Average mass332.278 Da
  • Monoisotopic mass331.093567 Da
  • ChemSpider ID23118415

More details:

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

Benzenepropanamine, N-[2-(3-bromophenyl)-1-methylethyl]- [ACD/Index Name]
N-[1-(3-Bromophenyl)-2-propanyl]-3-phenyl-1-propanamine [ACD/IUPAC Name]
N-[1-(3-Bromophényl)-2-propanyl]-3-phényl-1-propanamine [French] [ACD/IUPAC Name]
N-[1-(3-Bromphenyl)-2-propanyl]-3-phenyl-1-propanamin [German] [ACD/IUPAC Name]
[2-(3-Bromo-phenyl)-1-methyl-ethyl]-(3-phenyl-propyl)-amine
https://www.ebi.ac.uk/chembl/compoundreportcard/CHEMBL281619/
N-[1-(3-bromophenyl)propan-2-yl]-3-phenylpropan-1-amine

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

Density: 1.2±0.1 g/cm3
Boiling Point: 425.8±33.0 °C at 760 mmHg
Vapour Pressure: 0.0±1.0 mmHg at 25°C
Enthalpy of Vaporization: 68.1±3.0 kJ/mol
Flash Point: 211.3±25.4 °C
Index of Refraction: 1.570
Molar Refractivity: 90.1±0.3 cm3
#H bond acceptors: 1
#H bond donors: 1
#Freely Rotating Bonds: 7
#Rule of 5 Violations: 0
ACD/LogP: 4.78
ACD/LogD (pH 5.5): 1.94
ACD/BCF (pH 5.5): 3.17
ACD/KOC (pH 5.5): 10.55
ACD/LogD (pH 7.4): 2.44
ACD/BCF (pH 7.4): 10.19
ACD/KOC (pH 7.4): 33.87
Polar Surface Area: 12 Å2
Polarizability: 35.7±0.5 10-24cm3
Surface Tension: 40.2±3.0 dyne/cm
Molar Volume: 274.4±3.0 cm3

Click to predict properties on the Chemicalize site


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