ChemSpider 2D Image | (2S)-1-(2,6-Dimethylphenyl)-2-propanamine | C11H17N

(2S)-1-(2,6-Dimethylphenyl)-2-propanamine

  • Molecular FormulaC11H17N
  • Average mass163.259 Da
  • Monoisotopic mass163.136093 Da
  • ChemSpider ID65335427

  • defined stereocentres - 1 of 1 defined stereocentres

More details:

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

(2S)-1-(2,6-Dimethylphenyl)-2-propanamin [German] [ACD/IUPAC Name]
(2S)-1-(2,6-Dimethylphenyl)-2-propanamine [ACD/IUPAC Name]
(2S)-1-(2,6-Diméthylphényl)-2-propanamine [French] [ACD/IUPAC Name]
Benzeneethanamine, α,2,6-trimethyl-, (αS)- [ACD/Index Name]
(2S)-1-(2,6-dimethylphenyl)propan-2-amine
1188412-87-4 [RN]
MFCD20458196

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

Density: 0.9±0.1 g/cm3
Boiling Point: 256.2±9.0 °C at 760 mmHg
Vapour Pressure: 0.0±0.5 mmHg at 25°C
Enthalpy of Vaporization: 49.4±3.0 kJ/mol
Flash Point: 106.5±8.5 °C
Index of Refraction: 1.523
Molar Refractivity: 53.6±0.3 cm3
#H bond acceptors: 1
#H bond donors: 2
#Freely Rotating Bonds: 2
#Rule of 5 Violations: 0
ACD/LogP: 2.73
ACD/LogD (pH 5.5): -0.60
ACD/BCF (pH 5.5): 1.00
ACD/KOC (pH 5.5): 1.00
ACD/LogD (pH 7.4): 0.04
ACD/BCF (pH 7.4): 1.00
ACD/KOC (pH 7.4): 1.90
Polar Surface Area: 26 Å2
Polarizability: 21.2±0.5 10-24cm3
Surface Tension: 34.6±3.0 dyne/cm
Molar Volume: 175.4±3.0 cm3

Click to predict properties on the Chemicalize site


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