ChemSpider 2D Image | (2R)-4-Phenyl-2-(1,1,1-~2~H_3_)butanamine | C10H12D3N

(2R)-4-Phenyl-2-(1,1,1-2H3)butanamine

  • Molecular FormulaC10H12D3N
  • Average mass152.251 Da
  • Monoisotopic mass152.139282 Da
  • ChemSpider ID58782942
  • defined stereocentres - 1 of 1 defined stereocentres

    Non-standard isotope - Non-standard isotope


More details:






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

(2R)-4-Phenyl-2-(1,1,1-2H3)butanamin [German] [ACD/IUPAC Name]
(2R)-4-Phenyl-2-(1,1,1-2H3)butanamine [ACD/IUPAC Name]
(2R)-4-Phényl-2-(1,1,1-2H3)butanamine [French] [ACD/IUPAC Name]
Benzenepropanamine, α-(methyl-d3)-, (αR)- [ACD/Index Name]

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

Density: 0.9±0.1 g/cm3
Boiling Point: 221.5±0.0 °C at 760 mmHg
Vapour Pressure: 0.1±0.4 mmHg at 25°C
Enthalpy of Vaporization: 45.8±3.0 kJ/mol
Flash Point: 97.8±0.0 °C
Index of Refraction: 1.522
Molar Refractivity: 48.6±0.3 cm3
#H bond acceptors: 1
#H bond donors: 2
#Freely Rotating Bonds: 3
#Rule of 5 Violations: 0
ACD/LogP: 2.18
ACD/LogD (pH 5.5): -1.03
ACD/BCF (pH 5.5): 1.00
ACD/KOC (pH 5.5): 1.00
ACD/LogD (pH 7.4): -0.79
ACD/BCF (pH 7.4): 1.00
ACD/KOC (pH 7.4): 1.00
Polar Surface Area: 26 Å2
Polarizability: 19.3±0.5 10-24cm3
Surface Tension: 35.9±3.0 dyne/cm
Molar Volume: 159.3±3.0 cm3

Click to predict properties on the Chemicalize site






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