ChemSpider 2D Image | (2S)-2,3,4-Trihydroxybutanal | C4H8O4

(2S)-2,3,4-Trihydroxybutanal

  • Molecular FormulaC4H8O4
  • Average mass120.104 Da
  • Monoisotopic mass120.042259 Da
  • ChemSpider ID61490316

  • defined stereocentres - 1 of 2 defined stereocentres

More details:

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

(2S)-2,3,4-Trihydroxybutanal [German] [ACD/IUPAC Name]
(2S)-2,3,4-Trihydroxybutanal [ACD/IUPAC Name]
(2S)-2,3,4-Trihydroxybutanal [French] [ACD/IUPAC Name]
Butanal, 2,3,4-trihydroxy-, (2S)- [ACD/Index Name]
1933460-94-6 [RN]

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

Density: 1.4±0.1 g/cm3
Boiling Point: 311.1±21.0 °C at 760 mmHg
Vapour Pressure: 0.0±1.5 mmHg at 25°C
Enthalpy of Vaporization: 64.0±6.0 kJ/mol
Flash Point: 156.2±18.6 °C
Index of Refraction: 1.506
Molar Refractivity: 25.3±0.3 cm3
#H bond acceptors: 4
#H bond donors: 3
#Freely Rotating Bonds: 3
#Rule of 5 Violations: 0
ACD/LogP: -1.69
ACD/LogD (pH 5.5): -1.62
ACD/BCF (pH 5.5): 1.00
ACD/KOC (pH 5.5): 3.13
ACD/LogD (pH 7.4): -1.62
ACD/BCF (pH 7.4): 1.00
ACD/KOC (pH 7.4): 3.13
Polar Surface Area: 78 Å2
Polarizability: 10.0±0.5 10-24cm3
Surface Tension: 68.7±3.0 dyne/cm
Molar Volume: 85.2±3.0 cm3

Click to predict properties on the Chemicalize site


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