ChemSpider 2D Image | mk-1496 | C14H24N2O

mk-1496

  • Molecular FormulaC14H24N2O
  • Average mass236.353 Da
  • Monoisotopic mass236.188858 Da
  • ChemSpider ID28424184

  • defined stereocentres - 2 of 2 defined stereocentres

More details:

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

(1S)-1-{4-[(1S)-1-Aminoethyl]phenyl}-2-[(2-methyl-2-propanyl)amino]ethanol [German] [ACD/IUPAC Name]
(1S)-1-{4-[(1S)-1-Aminoethyl]phenyl}-2-[(2-methyl-2-propanyl)amino]ethanol [ACD/IUPAC Name]
(1S)-1-{4-[(1S)-1-Aminoéthyl]phényl}-2-[(2-méthyl-2-propanyl)amino]éthanol [French] [ACD/IUPAC Name]
1037254-47-9 [RN]
Benzenemethanol, 4-[(1S)-1-aminoethyl]-α-[[(1,1-dimethylethyl)amino]methyl]-, (αS)- [ACD/Index Name]
CS17H9370C
mk-1496
(1S)-1-[4-((1S)-1-Aminoethyl)phenyl]-2-(tert-butylamino)ethanol
UNII:CS17H9370C

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

Density: 1.0±0.1 g/cm3
Boiling Point: 352.2±21.0 °C at 760 mmHg
Vapour Pressure: 0.0±0.8 mmHg at 25°C
Enthalpy of Vaporization: 63.0±3.0 kJ/mol
Flash Point: 166.8±22.1 °C
Index of Refraction: 1.536
Molar Refractivity: 72.5±0.3 cm3
#H bond acceptors: 3
#H bond donors: 4
#Freely Rotating Bonds: 5
#Rule of 5 Violations: 0
ACD/LogP: 1.15
ACD/LogD (pH 5.5): -2.75
ACD/BCF (pH 5.5): 1.00
ACD/KOC (pH 5.5): 1.00
ACD/LogD (pH 7.4): -2.28
ACD/BCF (pH 7.4): 1.00
ACD/KOC (pH 7.4): 1.00
Polar Surface Area: 58 Å2
Polarizability: 28.7±0.5 10-24cm3
Surface Tension: 40.2±3.0 dyne/cm
Molar Volume: 232.6±3.0 cm3

Click to predict properties on the Chemicalize site


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