ChemSpider 2D Image | 2-[(S)-Cyclohexyl(phenyl)methyl]-N,N,N',N'-tetraethyl-1,3-propanediamine | C24H42N2

2-[(S)-Cyclohexyl(phenyl)methyl]-N,N,N',N'-tetraethyl-1,3-propanediamine

  • Molecular FormulaC24H42N2
  • Average mass358.604 Da
  • Monoisotopic mass358.334808 Da
  • ChemSpider ID34985531
  • defined stereocentres - 1 of 1 defined stereocentres


More details:






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

1,3-Propanediamine, 2-[(S)-cyclohexylphenylmethyl]-N1,N1,N3,N3-tetraethyl- [ACD/Index Name]
2-[(S)-Cyclohexyl(phenyl)methyl]-N,N,N',N'-tetraethyl-1,3-propandiamin [German] [ACD/IUPAC Name]
2-[(S)-Cyclohexyl(phenyl)methyl]-N,N,N',N'-tetraethyl-1,3-propanediamine [ACD/IUPAC Name]
2-[(S)-Cyclohexyl(phényl)méthyl]-N,N,N',N'-tétraéthyl-1,3-propanediamine [French] [ACD/IUPAC Name]
3590-16-7 [RN]
Feclemine [INN]
UNII-5P7U986QGO

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

G01WPV5IG0 [DBID]

Predicted data is generated using the ACD/Labs Percepta Platform - PhysChem Module

Density: 0.9±0.1 g/cm3
Boiling Point: 450.7±38.0 °C at 760 mmHg
Vapour Pressure: 0.0±1.1 mmHg at 25°C
Enthalpy of Vaporization: 71.0±3.0 kJ/mol
Flash Point: 197.9±14.6 °C
Index of Refraction: 1.515
Molar Refractivity: 115.2±0.3 cm3
#H bond acceptors: 2
#H bond donors: 0
#Freely Rotating Bonds: 11
#Rule of 5 Violations: 1
ACD/LogP: 7.13
ACD/LogD (pH 5.5): 1.92
ACD/BCF (pH 5.5): 1.82
ACD/KOC (pH 5.5): 3.77
ACD/LogD (pH 7.4): 2.94
ACD/BCF (pH 7.4): 18.73
ACD/KOC (pH 7.4): 38.85
Polar Surface Area: 6 Å2
Polarizability: 45.7±0.5 10-24cm3
Surface Tension: 36.1±3.0 dyne/cm
Molar Volume: 382.0±3.0 cm3

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