ChemSpider 2D Image | (6-Hydroxy-2-oxo-2H-chromen-4-yl)acetic acid | C11H8O5

(6-Hydroxy-2-oxo-2H-chromen-4-yl)acetic acid

  • Molecular FormulaC11H8O5
  • Average mass220.178 Da
  • Monoisotopic mass220.037170 Da
  • ChemSpider ID26055269

More details:

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

(6-Hydroxy-2-oxo-2H-chromen-4-yl)acetic acid [ACD/IUPAC Name]
(6-Hydroxy-2-oxo-2H-chromen-4-yl)essigsäure [German] [ACD/IUPAC Name]
2H-1-Benzopyran-4-acetic acid, 6-hydroxy-2-oxo- [ACD/Index Name]
Acide (6-hydroxy-2-oxo-2H-chromén-4-yl)acétique [French] [ACD/IUPAC Name]
2-(6-hydroxy-2-oxo-2H-chromen-4-yl)acetic acid
68747-26-2 [RN]
MFCD13196342 [MDL number]

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

Density: 1.5±0.1 g/cm3
Boiling Point: 538.5±50.0 °C at 760 mmHg
Vapour Pressure: 0.0±1.5 mmHg at 25°C
Enthalpy of Vaporization: 85.9±3.0 kJ/mol
Flash Point: 220.7±23.6 °C
Index of Refraction: 1.641
Molar Refractivity: 52.5±0.3 cm3
#H bond acceptors: 5
#H bond donors: 2
#Freely Rotating Bonds: 2
#Rule of 5 Violations: 0
ACD/LogP: 1.15
ACD/LogD (pH 5.5): 0.01
ACD/BCF (pH 5.5): 1.00
ACD/KOC (pH 5.5): 6.04
ACD/LogD (pH 7.4): -1.77
ACD/BCF (pH 7.4): 1.00
ACD/KOC (pH 7.4): 1.00
Polar Surface Area: 84 Å2
Polarizability: 20.8±0.5 10-24cm3
Surface Tension: 68.7±3.0 dyne/cm
Molar Volume: 145.7±3.0 cm3

Click to predict properties on the Chemicalize site


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