ChemSpider 2D Image | (2S,3R)-1-AMINO-2-METHYLBUTANE-2,3-DIOL | C5H13NO2

(2S,3R)-1-AMINO-2-METHYLBUTANE-2,3-DIOL

  • Molecular FormulaC5H13NO2
  • Average mass119.162 Da
  • Monoisotopic mass119.094627 Da
  • ChemSpider ID26329840

  • defined stereocentres - 2 of 2 defined stereocentres

More details:

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

(2S,3R)-1-AMINO-2-METHYLBUTANE-2,3-DIOL
(2S,3S)-1-Amino-2-methyl-2,3-butandiol [German] [ACD/IUPAC Name]
(2S,3S)-1-Amino-2-methyl-2,3-butanediol [ACD/IUPAC Name]
(2S,3S)-1-Amino-2-méthyl-2,3-butanediol [French] [ACD/IUPAC Name]
2,3-Butanediol, 1-amino-2-methyl-, (2S,3S)- [ACD/Index Name]
(2S,3S)-1-amino-2-methylbutane-2,3-diol

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

Density: 1.1±0.1 g/cm3
Boiling Point: 257.6±20.0 °C at 760 mmHg
Vapour Pressure: 0.0±1.2 mmHg at 25°C
Enthalpy of Vaporization: 57.5±6.0 kJ/mol
Flash Point: 109.6±21.8 °C
Index of Refraction: 1.488
Molar Refractivity: 31.7±0.3 cm3
#H bond acceptors: 3
#H bond donors: 4
#Freely Rotating Bonds: 2
#Rule of 5 Violations: 0
ACD/LogP: -1.28
ACD/LogD (pH 5.5): -3.84
ACD/BCF (pH 5.5): 1.00
ACD/KOC (pH 5.5): 1.00
ACD/LogD (pH 7.4): -2.65
ACD/BCF (pH 7.4): 1.00
ACD/KOC (pH 7.4): 1.00
Polar Surface Area: 66 Å2
Polarizability: 12.6±0.5 10-24cm3
Surface Tension: 45.4±3.0 dyne/cm
Molar Volume: 110.2±3.0 cm3

Click to predict properties on the Chemicalize site


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