Found 93 results

Search term: MF = 'C_{27}H_{32}N_{2}'
ChemSpider 2D Image | (2S)-1,2-Dibenzyl-4-(2-phenylethyl)-1,4-diazepane | C27H32N2

(2S)-1,2-Dibenzyl-4-(2-phenylethyl)-1,4-diazepane

  • Molecular FormulaC27H32N2
  • Average mass384.556 Da
  • Monoisotopic mass384.256561 Da
  • ChemSpider ID76793044

  • defined stereocentres - 1 of 1 defined stereocentres

More details:

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

(2S)-1,2-Dibenzyl-4-(2-phenylethyl)-1,4-diazepan [German] [ACD/IUPAC Name]
(2S)-1,2-Dibenzyl-4-(2-phenylethyl)-1,4-diazepane [ACD/IUPAC Name]
(2S)-1,2-Dibenzyl-4-(2-phényléthyl)-1,4-diazépane [French] [ACD/IUPAC Name]
1H-1,4-Diazepine, hexahydro-4-(2-phenylethyl)-1,2-bis(phenylmethyl)-, (2S)- [ACD/Index Name]

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

Density: 1.1±0.1 g/cm3
Boiling Point: 507.6±38.0 °C at 760 mmHg
Vapour Pressure: 0.0±1.3 mmHg at 25°C
Enthalpy of Vaporization: 77.8±3.0 kJ/mol
Flash Point: 227.6±14.6 °C
Index of Refraction: 1.593
Molar Refractivity: 122.3±0.3 cm3
#H bond acceptors: 2
#H bond donors: 0
#Freely Rotating Bonds: 7
#Rule of 5 Violations: 1
ACD/LogP: 6.11
ACD/LogD (pH 5.5): 2.58
ACD/BCF (pH 5.5): 9.45
ACD/KOC (pH 5.5): 22.31
ACD/LogD (pH 7.4): 3.65
ACD/BCF (pH 7.4): 111.55
ACD/KOC (pH 7.4): 263.43
Polar Surface Area: 6 Å2
Polarizability: 48.5±0.5 10-24cm3
Surface Tension: 44.5±3.0 dyne/cm
Molar Volume: 361.2±3.0 cm3

Click to predict properties on the Chemicalize site


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