ChemSpider 2D Image | tert-Butyl [(6-chloro-2,2'-dioxo-2H,2'H-3,4'-bichromen-7'-yl)oxy]acetate | C24H19ClO7

tert-Butyl [(6-chloro-2,2'-dioxo-2H,2'H-3,4'-bichromen-7'-yl)oxy]acetate

  • Molecular FormulaC24H19ClO7
  • Average mass454.857 Da
  • Monoisotopic mass454.081940 Da
  • ChemSpider ID24553332

More details:

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

[(6-Chloro-2,2'-dioxo-2H,2'H-3,4'-bichromén-7'-yl)oxy]acétate de 2-méthyl-2-propanyle [French] [ACD/IUPAC Name]
2-Methyl-2-propanyl [(6-chloro-2,2'-dioxo-2H,2'H-3,4'-bichromen-7'-yl)oxy]acetate [ACD/IUPAC Name]
2-Methyl-2-propanyl-[(6-chlor-2,2'-dioxo-2H,2'H-3,4'-bichromen-7'-yl)oxy]acetat [German] [ACD/IUPAC Name]
Acetic acid, 2-[(6-chloro-2,2'-dioxo[3,4'-bi-2H-1-benzopyran]-7'-yl)oxy]-, 1,1-dimethylethyl ester [ACD/Index Name]
tert-Butyl [(6-chloro-2,2'-dioxo-2H,2'H-3,4'-bichromen-7'-yl)oxy]acetate

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

Density: 1.4±0.1 g/cm3
Boiling Point: 634.2±55.0 °C at 760 mmHg
Vapour Pressure: 0.0±1.9 mmHg at 25°C
Enthalpy of Vaporization: 93.7±3.0 kJ/mol
Flash Point: 227.3±30.5 °C
Index of Refraction: 1.617
Molar Refractivity: 114.0±0.3 cm3
#H bond acceptors: 7
#H bond donors: 0
#Freely Rotating Bonds: 6
#Rule of 5 Violations: 1
ACD/LogP: 5.07
ACD/LogD (pH 5.5): 5.02
ACD/BCF (pH 5.5): 3866.59
ACD/KOC (pH 5.5): 12864.80
ACD/LogD (pH 7.4): 5.02
ACD/BCF (pH 7.4): 3866.59
ACD/KOC (pH 7.4): 12864.80
Polar Surface Area: 88 Å2
Polarizability: 45.2±0.5 10-24cm3
Surface Tension: 56.2±3.0 dyne/cm
Molar Volume: 325.8±3.0 cm3

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