Found 45 results

Search term: MF = 'C_{30}H_{31}NO'
ChemSpider 2D Image | N-{(2S)-3-[(3,5-Dimethylbenzyl)oxy]-1,1-diphenyl-2-propanyl}aniline | C30H31NO

N-{(2S)-3-[(3,5-Dimethylbenzyl)oxy]-1,1-diphenyl-2-propanyl}aniline

  • Molecular FormulaC30H31NO
  • Average mass421.573 Da
  • Monoisotopic mass421.240570 Da
  • ChemSpider ID23202962

  • defined stereocentres - 1 of 1 defined stereocentres

More details:

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

Benzeneethanamine, α-[[(3,5-dimethylphenyl)methoxy]methyl]-N,β-diphenyl-, (αS)- [ACD/Index Name]
N-{(2S)-3-[(3,5-Dimethylbenzyl)oxy]-1,1-diphenyl-2-propanyl}anilin [German] [ACD/IUPAC Name]
N-{(2S)-3-[(3,5-Dimethylbenzyl)oxy]-1,1-diphenyl-2-propanyl}aniline [ACD/IUPAC Name]
N-{(2S)-3-[(3,5-Diméthylbenzyl)oxy]-1,1-diphényl-2-propanyl}aniline [French] [ACD/IUPAC Name]
N-{(2S)-3-[(3,5-dimethylbenzyl)oxy]-1,1-diphenylpropan-2-yl}aniline
[(S)-1-(3,5-Dimethyl-benzyloxymethyl)-2,2-diphenyl-ethyl]-phenyl-amine

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

Density: 1.1±0.1 g/cm3
Boiling Point: 595.5±50.0 °C at 760 mmHg
Vapour Pressure: 0.0±1.7 mmHg at 25°C
Enthalpy of Vaporization: 88.7±3.0 kJ/mol
Flash Point: 257.2±19.6 °C
Index of Refraction: 1.620
Molar Refractivity: 134.5±0.3 cm3
#H bond acceptors: 2
#H bond donors: 1
#Freely Rotating Bonds: 9
#Rule of 5 Violations: 1
ACD/LogP: 8.29
ACD/LogD (pH 5.5): 7.65
ACD/BCF (pH 5.5): 374885.63
ACD/KOC (pH 5.5): 331527.28
ACD/LogD (pH 7.4): 7.69
ACD/BCF (pH 7.4): 408858.69
ACD/KOC (pH 7.4): 361571.06
Polar Surface Area: 21 Å2
Polarizability: 53.3±0.5 10-24cm3
Surface Tension: 45.6±3.0 dyne/cm
Molar Volume: 382.9±3.0 cm3

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