ChemSpider 2D Image | 1-(3-Chlorophenyl)-2-{[2-(~2~H_3_)methyl(~2~H_6_)-2-propanyl]amino}-1-propanol | C13H11D9ClNO

1-(3-Chlorophenyl)-2-{[2-(2H3)methyl(2H6)-2-propanyl]amino}-1-propanol

  • Molecular FormulaC13H11D9ClNO
  • Average mass250.813 Da
  • Monoisotopic mass250.179840 Da
  • ChemSpider ID26458627

  • Non-standard isotope - Non-standard isotope

More details:

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

1-(3-Chlorophenyl)-2-{[2-(2H3)methyl(2H6)-2-propanyl]amino}-1-propanol [ACD/IUPAC Name]
1-(3-Chlorophényl)-2-{[2-(2H3)méthyl(2H6)-2-propanyl]amino}-1-propanol [French] [ACD/IUPAC Name]
1-(3-Chlorphenyl)-2-{[2-(2H3)methyl(2H6)-2-propanyl]amino}-1-propanol [German] [ACD/IUPAC Name]
Benzenemethanol, 3-chloro-α-[1-[[1,1-di(methyl-d3)ethyl-2,2,2-d3]amino]ethyl]- [ACD/Index Name]
1-(3-Chlorophenyl)-2-{[2-(2H3)methyl(2H6)propan-2-yl]amino}propan-1-ol
1215071-07-0 [RN]
3-chloro-?-[1-[(1,1-dimethylethyl)amino]ethyl]-benzenemethanol-d9
Dihydrobupropion-d9
MFCD18427978 [MDL number]
SS-4482

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

Density: 1.1±0.1 g/cm3
Boiling Point: 347.2±27.0 °C at 760 mmHg
Vapour Pressure: 0.0±0.8 mmHg at 25°C
Enthalpy of Vaporization: 62.4±3.0 kJ/mol
Flash Point: 163.8±23.7 °C
Index of Refraction: 1.527
Molar Refractivity: 68.9±0.3 cm3
#H bond acceptors: 2
#H bond donors: 2
#Freely Rotating Bonds: 4
#Rule of 5 Violations: 0
ACD/LogP: 2.88
ACD/LogD (pH 5.5): -0.20
ACD/BCF (pH 5.5): 1.00
ACD/KOC (pH 5.5): 1.00
ACD/LogD (pH 7.4): 0.73
ACD/BCF (pH 7.4): 1.00
ACD/KOC (pH 7.4): 6.36
Polar Surface Area: 32 Å2
Polarizability: 27.3±0.5 10-24cm3
Surface Tension: 37.4±3.0 dyne/cm
Molar Volume: 224.2±3.0 cm3

Click to predict properties on the Chemicalize site


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