ChemSpider 2D Image | (1R,2S)-2-(3,4-Dimethoxyphenyl)cyclopropanamine | C11H15NO2

(1R,2S)-2-(3,4-Dimethoxyphenyl)cyclopropanamine

  • Molecular FormulaC11H15NO2
  • Average mass193.242 Da
  • Monoisotopic mass193.110275 Da
  • ChemSpider ID24205354

  • defined stereocentres - 2 of 2 defined stereocentres

More details:

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

(1R,2S)-2-(3,4-Dimethoxyphenyl)cyclopropanamin [German] [ACD/IUPAC Name]
(1R,2S)-2-(3,4-Dimethoxyphenyl)cyclopropanamine [ACD/IUPAC Name]
(1R,2S)-2-(3,4-Diméthoxyphényl)cyclopropanamine [French] [ACD/IUPAC Name]
Cyclopropanamine, 2-(3,4-dimethoxyphenyl)-, (1R,2S)- [ACD/Index Name]
773809-98-6 [RN]
Cyclopropanamine, 2-(3,4-dimethoxyphenyl)-, trans- (9CI)
MFCD17010158
rac-(1R,2S)-2-(3,4-dimethoxyphenyl)cyclopropan-1-amine

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

Density: 1.1±0.1 g/cm3
Boiling Point: 291.4±40.0 °C at 760 mmHg
Vapour Pressure: 0.0±0.6 mmHg at 25°C
Enthalpy of Vaporization: 53.1±3.0 kJ/mol
Flash Point: 141.5±34.6 °C
Index of Refraction: 1.551
Molar Refractivity: 55.2±0.3 cm3
#H bond acceptors: 3
#H bond donors: 2
#Freely Rotating Bonds: 3
#Rule of 5 Violations: 0
ACD/LogP: 0.99
ACD/LogD (pH 5.5): -1.56
ACD/BCF (pH 5.5): 1.00
ACD/KOC (pH 5.5): 1.00
ACD/LogD (pH 7.4): 0.11
ACD/BCF (pH 7.4): 1.00
ACD/KOC (pH 7.4): 10.00
Polar Surface Area: 44 Å2
Polarizability: 21.9±0.5 10-24cm3
Surface Tension: 40.6±3.0 dyne/cm
Molar Volume: 173.0±3.0 cm3

Click to predict properties on the Chemicalize site


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