ChemSpider 2D Image | 6-Methoxy-isochroman-1-one | C10H10O3

6-Methoxy-isochroman-1-one

  • Molecular FormulaC10H10O3
  • Average mass178.185 Da
  • Monoisotopic mass178.062988 Da
  • ChemSpider ID21514130

More details:

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

1H-2-Benzopyran-1-one, 3,4-dihydro-6-methoxy- [ACD/Index Name]
20678-26-6 [RN]
6-Methoxy-3,4-dihydro-1H-isochromen-1-on [German] [ACD/IUPAC Name]
6-Methoxy-3,4-dihydro-1H-isochromen-1-one [ACD/IUPAC Name]
6-Méthoxy-3,4-dihydro-1H-isochromén-1-one [French] [ACD/IUPAC Name]
6-Methoxy-isochroman-1-one
6-Methoxy-3,4-dihydro-1H-2-benzopyran-1-one
6-METHOXY-3,4-DIHYDRO-2-BENZOPYRAN-1-ONE
6-Methoxyisochroman-1-one
MFCD09031911 [MDL number]

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

Density: 1.2±0.1 g/cm3
Boiling Point: 377.7±42.0 °C at 760 mmHg
Vapour Pressure: 0.0±0.9 mmHg at 25°C
Enthalpy of Vaporization: 62.6±3.0 kJ/mol
Flash Point: 158.6±22.5 °C
Index of Refraction: 1.547
Molar Refractivity: 46.8±0.3 cm3
#H bond acceptors: 3
#H bond donors: 0
#Freely Rotating Bonds: 1
#Rule of 5 Violations: 0
ACD/LogP: 1.40
ACD/LogD (pH 5.5): 2.14
ACD/BCF (pH 5.5): 24.87
ACD/KOC (pH 5.5): 347.28
ACD/LogD (pH 7.4): 2.14
ACD/BCF (pH 7.4): 24.87
ACD/KOC (pH 7.4): 347.28
Polar Surface Area: 36 Å2
Polarizability: 18.6±0.5 10-24cm3
Surface Tension: 42.2±3.0 dyne/cm
Molar Volume: 147.8±3.0 cm3

Click to predict properties on the Chemicalize site


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