ChemSpider 2D Image | 6-Hydroxy-2,4-hexadiynoic acid | C6H4O3

6-Hydroxy-2,4-hexadiynoic acid

  • Molecular FormulaC6H4O3
  • Average mass124.094 Da
  • Monoisotopic mass124.016045 Da
  • ChemSpider ID32990519

More details:

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

2,4-Hexadiynoic acid, 6-hydroxy- [ACD/Index Name]
6-Hydroxy-2,4-hexadiinsäure [German] [ACD/IUPAC Name]
6-Hydroxy-2,4-hexadiynoic acid [ACD/IUPAC Name]
Acide 6-hydroxy-2,4-hexadiynoïque [French] [ACD/IUPAC Name]
98141-88-9 [RN]
MFCD19229413

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

Density: 1.4±0.1 g/cm3
Boiling Point: 304.8±44.0 °C at 760 mmHg
Vapour Pressure: 0.0±1.4 mmHg at 25°C
Enthalpy of Vaporization: 63.2±6.0 kJ/mol
Flash Point: 152.4±24.9 °C
Index of Refraction: 1.586
Molar Refractivity: 29.0±0.3 cm3
#H bond acceptors: 3
#H bond donors: 2
#Freely Rotating Bonds: 3
#Rule of 5 Violations: 0
ACD/LogP: 1.59
ACD/LogD (pH 5.5): -2.09
ACD/BCF (pH 5.5): 1.00
ACD/KOC (pH 5.5): 1.00
ACD/LogD (pH 7.4): -2.53
ACD/BCF (pH 7.4): 1.00
ACD/KOC (pH 7.4): 1.00
Polar Surface Area: 58 Å2
Polarizability: 11.5±0.5 10-24cm3
Surface Tension: 89.8±3.0 dyne/cm
Molar Volume: 86.3±3.0 cm3

Click to predict properties on the Chemicalize site


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