ChemSpider 2D Image | (2S,3S)-2-Methyl-1,2,3,4-butanetetrol | C5H12O4

(2S,3S)-2-Methyl-1,2,3,4-butanetetrol

  • Molecular FormulaC5H12O4
  • Average mass136.146 Da
  • Monoisotopic mass136.073563 Da
  • ChemSpider ID24534971

  • defined stereocentres - 2 of 2 defined stereocentres

More details:

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

(2S,3S)-2-Methyl-1,2,3,4-butanetetrol [ACD/IUPAC Name]
(2S,3S)-2-Méthyl-1,2,3,4-butanetétrol [French] [ACD/IUPAC Name]
(2S,3S)-2-Methyl-1,2,3,4-butantetrol [German] [ACD/IUPAC Name]
(2S,3S)-2-Methylbutane-1,2,3,4-tetrol
1,2,3,4-Butanetetrol, 2-methyl-, (2S,3S)- [ACD/Index Name]
2-C-METHYL-L-THREITOL
93921-84-7 [RN]

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

Density: 1.3±0.1 g/cm3
Boiling Point: 368.1±37.0 °C at 760 mmHg
Vapour Pressure: 0.0±1.9 mmHg at 25°C
Enthalpy of Vaporization: 71.1±6.0 kJ/mol
Flash Point: 193.0±21.1 °C
Index of Refraction: 1.528
Molar Refractivity: 31.3±0.3 cm3
#H bond acceptors: 4
#H bond donors: 4
#Freely Rotating Bonds: 3
#Rule of 5 Violations: 0
ACD/LogP: -2.65
ACD/LogD (pH 5.5): -1.90
ACD/BCF (pH 5.5): 1.00
ACD/KOC (pH 5.5): 2.22
ACD/LogD (pH 7.4): -1.90
ACD/BCF (pH 7.4): 1.00
ACD/KOC (pH 7.4): 2.22
Polar Surface Area: 81 Å2
Polarizability: 12.4±0.5 10-24cm3
Surface Tension: 67.0±3.0 dyne/cm
Molar Volume: 101.5±3.0 cm3

Click to predict properties on the Chemicalize site


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