ChemSpider 2D Image | (2S)-2-Amino-2-(4-iodo-3,5-dimethylphenyl)ethanol | C10H14INO

(2S)-2-Amino-2-(4-iodo-3,5-dimethylphenyl)ethanol

  • Molecular FormulaC10H14INO
  • Average mass291.129 Da
  • Monoisotopic mass291.011993 Da
  • ChemSpider ID27446547
  • defined stereocentres - 1 of 1 defined stereocentres


More details:






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

(2S)-2-Amino-2-(4-iod-3,5-dimethylphenyl)ethanol [German] [ACD/IUPAC Name]
(2S)-2-Amino-2-(4-iodo-3,5-dimethylphenyl)ethanol [ACD/IUPAC Name]
(2S)-2-Amino-2-(4-iodo-3,5-diméthylphényl)éthanol [French] [ACD/IUPAC Name]
Benzeneethanol, β-amino-4-iodo-3,5-dimethyl-, (βS)- [ACD/Index Name]
(2S)-2-AMINO-2-(4-IODO-3,5-DIMETHYLPHENYL)ETHAN-1-OL
MFCD14567522

Predicted data is generated using the ACD/Labs Percepta Platform - PhysChem Module

Density: 1.6±0.1 g/cm3
Boiling Point: 381.7±42.0 °C at 760 mmHg
Vapour Pressure: 0.0±0.9 mmHg at 25°C
Enthalpy of Vaporization: 66.5±3.0 kJ/mol
Flash Point: 184.7±27.9 °C
Index of Refraction: 1.628
Molar Refractivity: 63.4±0.3 cm3
#H bond acceptors: 2
#H bond donors: 3
#Freely Rotating Bonds: 2
#Rule of 5 Violations: 0
ACD/LogP: 2.37
ACD/LogD (pH 5.5): -1.09
ACD/BCF (pH 5.5): 1.00
ACD/KOC (pH 5.5): 1.00
ACD/LogD (pH 7.4): -0.29
ACD/BCF (pH 7.4): 1.00
ACD/KOC (pH 7.4): 1.51
Polar Surface Area: 46 Å2
Polarizability: 25.1±0.5 10-24cm3
Surface Tension: 51.6±3.0 dyne/cm
Molar Volume: 178.8±3.0 cm3

Click to predict properties on the Chemicalize site






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