ChemSpider 2D Image | (2Z)-6-Bromo-2-[(5,5-dimethyl-2-oxido-1,3,2-dioxaphosphinan-2-yl)(phenyl)methylene]-2H-chromene | C21H20BrO4P

(2Z)-6-Bromo-2-[(5,5-dimethyl-2-oxido-1,3,2-dioxaphosphinan-2-yl)(phenyl)methylene]-2H-chromene

  • Molecular FormulaC21H20BrO4P
  • Average mass447.259 Da
  • Monoisotopic mass446.028259 Da
  • ChemSpider ID30659002

  • Double-bond stereo - Double-bond stereo

More details:

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

(2Z)-6-Brom-2-[(5,5-dimethyl-2-oxido-1,3,2-dioxaphosphinan-2-yl)(phenyl)methylen]-2H-chromen [German] [ACD/IUPAC Name]
(2Z)-6-Bromo-2-[(5,5-dimethyl-2-oxido-1,3,2-dioxaphosphinan-2-yl)(phenyl)methylene]-2H-chromene [ACD/IUPAC Name]
(2Z)-6-Bromo-2-[(5,5-diméthyl-2-oxydo-1,3,2-dioxaphosphinan-2-yl)(phényl)méthylène]-2H-chromène [French] [ACD/IUPAC Name]
2H-1-Benzopyran, 6-bromo-2-[(5,5-dimethyl-2-oxido-1,3,2-dioxaphosphorinan-2-yl)phenylmethylene]-, (2Z)- [ACD/Index Name]

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

Density: 1.5±0.1 g/cm3
Boiling Point: 550.1±50.0 °C at 760 mmHg
Vapour Pressure: 0.0±1.4 mmHg at 25°C
Enthalpy of Vaporization: 79.9±3.0 kJ/mol
Flash Point: 286.5±30.1 °C
Index of Refraction: 1.633
Molar Refractivity: 108.1±0.4 cm3
#H bond acceptors: 4
#H bond donors: 0
#Freely Rotating Bonds: 2
#Rule of 5 Violations: 1
ACD/LogP: 6.12
ACD/LogD (pH 5.5): 5.05
ACD/BCF (pH 5.5): 4066.30
ACD/KOC (pH 5.5): 13337.03
ACD/LogD (pH 7.4): 5.05
ACD/BCF (pH 7.4): 4066.30
ACD/KOC (pH 7.4): 13337.03
Polar Surface Area: 55 Å2
Polarizability: 42.9±0.5 10-24cm3
Surface Tension: 55.1±5.0 dyne/cm
Molar Volume: 302.7±5.0 cm3

Click to predict properties on the Chemicalize site


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