ChemSpider 2D Image | 2-[3-(Diisopropylamino)-1-phenylpropyl]-4-(~2~H_3_)methyl(3,5-~2~H_2_)phenol | C22H26D5NO

2-[3-(Diisopropylamino)-1-phenylpropyl]-4-(2H3)methyl(3,5-2H2)phenol

  • Molecular FormulaC22H26D5NO
  • Average mass330.518 Da
  • Monoisotopic mass330.271942 Da
  • ChemSpider ID110404727

  • Non-standard isotope - Non-standard isotope

More details:

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

2-[3-(Diisopropylamino)-1-phenylpropyl]-4-(2H3)methyl(3,5-2H2)phenol [German] [ACD/IUPAC Name]
2-[3-(Diisopropylamino)-1-phenylpropyl]-4-(2H3)methyl(3,5-2H2)phenol [ACD/IUPAC Name]
2-[3-(Diisopropylamino)-1-phénylpropyl]-4-(2H3)méthyl(3,5-2H2)phénol [French] [ACD/IUPAC Name]
Phenol-3,5-d2, 2-[3-[bis(1-methylethyl)amino]-1-phenylpropyl]-4-(methyl-d3)- [ACD/Index Name]

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

Density: 1.0±0.1 g/cm3
Boiling Point: 442.2±45.0 °C at 760 mmHg
Vapour Pressure: 0.0±1.1 mmHg at 25°C
Enthalpy of Vaporization: 72.7±3.0 kJ/mol
Flash Point: 192.1±27.4 °C
Index of Refraction: 1.548
Molar Refractivity: 103.0±0.3 cm3
#H bond acceptors: 2
#H bond donors: 1
#Freely Rotating Bonds: 7
#Rule of 5 Violations: 1
ACD/LogP: 5.77
ACD/LogD (pH 5.5): 2.33
ACD/BCF (pH 5.5): 6.22
ACD/KOC (pH 5.5): 16.98
ACD/LogD (pH 7.4): 2.57
ACD/BCF (pH 7.4): 10.89
ACD/KOC (pH 7.4): 29.73
Polar Surface Area: 23 Å2
Polarizability: 40.8±0.5 10-24cm3
Surface Tension: 38.6±3.0 dyne/cm
Molar Volume: 324.3±3.0 cm3

Click to predict properties on the Chemicalize site


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