ChemSpider 2D Image | 3-[(1R)-1-(Dimethylamino)ethyl]phenyl methylcarbamate | C12H18N2O2

3-[(1R)-1-(Dimethylamino)ethyl]phenyl methylcarbamate

  • Molecular FormulaC12H18N2O2
  • Average mass222.283 Da
  • Monoisotopic mass222.136826 Da
  • ChemSpider ID58828503

  • defined stereocentres - 1 of 1 defined stereocentres

More details:

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

3-[(1R)-1-(Dimethylamino)ethyl]phenyl methylcarbamate [ACD/IUPAC Name]
3-[(1R)-1-(Dimethylamino)ethyl]phenyl-methylcarbamat [German] [ACD/IUPAC Name]
Méthylcarbamate de 3-[(1R)-1-(diméthylamino)éthyl]phényle [French] [ACD/IUPAC Name]
Phenol, 3-[(1R)-1-(dimethylamino)ethyl]-, methylcarbamate (ester) [ACD/Index Name]
MIOTINE, (R)-

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

91PXB98VVE [DBID]
UNII:91PXB98VVE [DBID]

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

Density: 1.1±0.1 g/cm3
Boiling Point: 282.0±32.0 °C at 760 mmHg
Vapour Pressure: 0.0±0.6 mmHg at 25°C
Enthalpy of Vaporization: 52.1±3.0 kJ/mol
Flash Point: 124.3±25.1 °C
Index of Refraction: 1.520
Molar Refractivity: 63.7±0.3 cm3
#H bond acceptors: 4
#H bond donors: 1
#Freely Rotating Bonds: 4
#Rule of 5 Violations: 0
ACD/LogP: 1.27
ACD/LogD (pH 5.5): -1.16
ACD/BCF (pH 5.5): 1.00
ACD/KOC (pH 5.5): 1.00
ACD/LogD (pH 7.4): 0.44
ACD/BCF (pH 7.4): 1.00
ACD/KOC (pH 7.4): 12.29
Polar Surface Area: 42 Å2
Polarizability: 25.3±0.5 10-24cm3
Surface Tension: 37.0±3.0 dyne/cm
Molar Volume: 209.7±3.0 cm3

Click to predict properties on the Chemicalize site


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