ChemSpider 2D Image | 2-Methyl-2-propanyl [(6-hexyl-2-oxo-4-phenyl-2H-chromen-7-yl)oxy]acetate | C27H32O5

2-Methyl-2-propanyl [(6-hexyl-2-oxo-4-phenyl-2H-chromen-7-yl)oxy]acetate

  • Molecular FormulaC27H32O5
  • Average mass436.540 Da
  • Monoisotopic mass436.224976 Da
  • ChemSpider ID21675305

More details:

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

[(6-Hexyl-2-oxo-4-phényl-2H-chromén-7-yl)oxy]acétate de 2-méthyl-2-propanyle [French] [ACD/IUPAC Name]
2-Methyl-2-propanyl [(6-hexyl-2-oxo-4-phenyl-2H-chromen-7-yl)oxy]acetate [ACD/IUPAC Name]
2-Methyl-2-propanyl-[(6-hexyl-2-oxo-4-phenyl-2H-chromen-7-yl)oxy]acetat [German] [ACD/IUPAC Name]
Acetic acid, 2-[(6-hexyl-2-oxo-4-phenyl-2H-1-benzopyran-7-yl)oxy]-, 1,1-dimethylethyl ester [ACD/Index Name]
(6-Hexyl-2-oxo-4-phenyl-2H-chromen-7-yloxy)-acetic acid tert-butyl ester
405908-21-6 [RN]
tert-butyl [(6-hexyl-2-oxo-4-phenyl-2H-chromen-7-yl)oxy]acetate
tert-butyl 2-((6-hexyl-2-oxo-4-phenyl-2H-chromen-7-yl)oxy)acetate
tert-butyl 2-(6-hexyl-2-oxo-4-phenylchromen-7-yloxy)acetate

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

Density: 1.1±0.1 g/cm3
Boiling Point: 562.6±50.0 °C at 760 mmHg
Vapour Pressure: 0.0±1.5 mmHg at 25°C
Enthalpy of Vaporization: 84.6±3.0 kJ/mol
Flash Point: 239.7±30.2 °C
Index of Refraction: 1.551
Molar Refractivity: 123.9±0.3 cm3
#H bond acceptors: 5
#H bond donors: 0
#Freely Rotating Bonds: 11
#Rule of 5 Violations: 1
ACD/LogP: 7.60
ACD/LogD (pH 5.5): 7.35
ACD/BCF (pH 5.5): 225762.11
ACD/KOC (pH 5.5): 236438.80
ACD/LogD (pH 7.4): 7.35
ACD/BCF (pH 7.4): 225762.11
ACD/KOC (pH 7.4): 236438.80
Polar Surface Area: 62 Å2
Polarizability: 49.1±0.5 10-24cm3
Surface Tension: 43.2±3.0 dyne/cm
Molar Volume: 388.2±3.0 cm3

Click to predict properties on the Chemicalize site


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