ChemSpider 2D Image | 2-(1,3-Benzoxazol-2-yl)-1-(4-butoxyphenyl)-3-[5-(2,5-dichlorophenyl)-2-furyl]-2-propen-1-one | C30H23Cl2NO4

2-(1,3-Benzoxazol-2-yl)-1-(4-butoxyphenyl)-3-[5-(2,5-dichlorophenyl)-2-furyl]-2-propen-1-one

  • Molecular FormulaC30H23Cl2NO4
  • Average mass532.414 Da
  • Monoisotopic mass531.100403 Da
  • ChemSpider ID4231089

More details:

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

2-(1,3-Benzoxazol-2-yl)-1-(4-butoxyphenyl)-3-[5-(2,5-dichlorophenyl)-2-furyl]-2-propen-1-one [ACD/IUPAC Name]
2-(1,3-Benzoxazol-2-yl)-1-(4-butoxyphényl)-3-[5-(2,5-dichlorophényl)-2-furyl]-2-propén-1-one [French] [ACD/IUPAC Name]
2-(1,3-Benzoxazol-2-yl)-1-(4-butoxyphenyl)-3-[5-(2,5-dichlorphenyl)-2-furyl]-2-propen-1-on [German] [ACD/IUPAC Name]
2-Propen-1-one, 2-(2-benzoxazolyl)-1-(4-butoxyphenyl)-3-[5-(2,5-dichlorophenyl)-2-furanyl]- [ACD/Index Name]

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

Density: 1.3±0.1 g/cm3
Boiling Point: 670.1±65.0 °C at 760 mmHg
Vapour Pressure: 0.0±2.0 mmHg at 25°C
Enthalpy of Vaporization: 98.5±3.0 kJ/mol
Flash Point: 359.0±34.3 °C
Index of Refraction: 1.643
Molar Refractivity: 147.4±0.3 cm3
#H bond acceptors: 5
#H bond donors: 0
#Freely Rotating Bonds: 9
#Rule of 5 Violations: 2
ACD/LogP: 10.04
ACD/LogD (pH 5.5): 7.91
ACD/BCF (pH 5.5): 610007.38
ACD/KOC (pH 5.5): 481628.91
ACD/LogD (pH 7.4): 7.91
ACD/BCF (pH 7.4): 610010.69
ACD/KOC (pH 7.4): 481631.56
Polar Surface Area: 65 Å2
Polarizability: 58.4±0.5 10-24cm3
Surface Tension: 51.1±3.0 dyne/cm
Molar Volume: 407.6±3.0 cm3

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