Found 1 result

Search term: InChI=1S/C4H6O4/c5-1-3(7)4(8)2-6/h5-6H,1-2H2 (Found by conversion of search term to chemical structure (full match))

ChemSpider 2D Image | 1,4-Dihydroxy-2,3-butanedione | C4H6O4

1,4-Dihydroxy-2,3-butanedione

  • Molecular FormulaC4H6O4
  • Average mass118.088 Da
  • Monoisotopic mass118.026611 Da
  • ChemSpider ID60824063

More details:






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

1,4-Dihydroxy-2,3-butandion [German] [ACD/IUPAC Name]
1,4-Dihydroxy-2,3-butanedione [ACD/IUPAC Name]
1,4-Dihydroxy-2,3-butanedione [French] [ACD/IUPAC Name]
162369-87-1 [RN]
2,3-Butanedione, 1,4-dihydroxy- [ACD/Index Name]
MFCD24696853

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

Density: 1.4±0.1 g/cm3
Boiling Point: 238.0±25.0 °C at 760 mmHg
Vapour Pressure: 0.0±1.0 mmHg at 25°C
Enthalpy of Vaporization: 55.2±6.0 kJ/mol
Flash Point: 112.0±19.7 °C
Index of Refraction: 1.478
Molar Refractivity: 23.7±0.3 cm3
#H bond acceptors: 4
#H bond donors: 2
#Freely Rotating Bonds: 3
#Rule of 5 Violations: 0
ACD/LogP: -2.82
ACD/LogD (pH 5.5): -1.91
ACD/BCF (pH 5.5): 1.00
ACD/KOC (pH 5.5): 2.17
ACD/LogD (pH 7.4): -1.91
ACD/BCF (pH 7.4): 1.00
ACD/KOC (pH 7.4): 2.17
Polar Surface Area: 75 Å2
Polarizability: 9.4±0.5 10-24cm3
Surface Tension: 61.7±3.0 dyne/cm
Molar Volume: 83.8±3.0 cm3

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