ChemSpider 2D Image | 1-(Benzylamino)-3-{2,6-bis(2-methyl-2-propanyl)-4-[(E)-2-phenylvinyl]phenoxy}-2-propanol | C32H41NO2

1-(Benzylamino)-3-{2,6-bis(2-methyl-2-propanyl)-4-[(E)-2-phenylvinyl]phenoxy}-2-propanol

  • Molecular FormulaC32H41NO2
  • Average mass471.673 Da
  • Monoisotopic mass471.313721 Da
  • ChemSpider ID34242815

  • Double-bond stereo - Double-bond stereo

More details:

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

1-(Benzylamino)-3-{2,6-bis(2-methyl-2-propanyl)-4-[(E)-2-phenylvinyl]phenoxy}-2-propanol [German] [ACD/IUPAC Name]
1-(Benzylamino)-3-{2,6-bis(2-methyl-2-propanyl)-4-[(E)-2-phenylvinyl]phenoxy}-2-propanol [ACD/IUPAC Name]
1-(Benzylamino)-3-{2,6-bis(2-méthyl-2-propanyl)-4-[(E)-2-phénylvinyl]phénoxy}-2-propanol [French] [ACD/IUPAC Name]
2-Propanol, 1-[2,6-bis(1,1-dimethylethyl)-4-[(E)-2-phenylethenyl]phenoxy]-3-[(phenylmethyl)amino]- [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: 627.8±55.0 °C at 760 mmHg
Vapour Pressure: 0.0±1.9 mmHg at 25°C
Enthalpy of Vaporization: 97.7±3.0 kJ/mol
Flash Point: 333.5±31.5 °C
Index of Refraction: 1.589
Molar Refractivity: 150.6±0.3 cm3
#H bond acceptors: 3
#H bond donors: 2
#Freely Rotating Bonds: 11
#Rule of 5 Violations: 1
ACD/LogP: 8.76
ACD/LogD (pH 5.5): 4.95
ACD/BCF (pH 5.5): 741.69
ACD/KOC (pH 5.5): 653.43
ACD/LogD (pH 7.4): 6.56
ACD/BCF (pH 7.4): 30701.21
ACD/KOC (pH 7.4): 27047.64
Polar Surface Area: 41 Å2
Polarizability: 59.7±0.5 10-24cm3
Surface Tension: 40.6±3.0 dyne/cm
Molar Volume: 446.9±3.0 cm3

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