ChemSpider 2D Image | 2-[(2-Methoxydibenzo[b,d]furan-3-yl)amino]-2-oxoethyl {4-[(3,5-dimethyl-1,2-oxazol-4-yl)methoxy]phenyl}acetate | C29H26N2O7

2-[(2-Methoxydibenzo[b,d]furan-3-yl)amino]-2-oxoethyl {4-[(3,5-dimethyl-1,2-oxazol-4-yl)methoxy]phenyl}acetate

  • Molecular FormulaC29H26N2O7
  • Average mass514.526 Da
  • Monoisotopic mass514.174011 Da
  • ChemSpider ID1899163

More details:

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

{4-[(3,5-Diméthyl-1,2-oxazol-4-yl)méthoxy]phényl}acétate de 2-[(2-méthoxydibenzo[b,d]furan-3-yl)amino]-2-oxoéthyle [French] [ACD/IUPAC Name]
2-[(2-Methoxydibenzo[b,d]furan-3-yl)amino]-2-oxoethyl {4-[(3,5-dimethyl-1,2-oxazol-4-yl)methoxy]phenyl}acetate [ACD/IUPAC Name]
2-[(2-Methoxydibenzo[b,d]furan-3-yl)amino]-2-oxoethyl-{4-[(3,5-dimethyl-1,2-oxazol-4-yl)methoxy]phenyl}acetat [German] [ACD/IUPAC Name]
Benzeneacetic acid, 4-[(3,5-dimethyl-4-isoxazolyl)methoxy]-, 2-[(2-methoxy-3-dibenzofuranyl)amino]-2-oxoethyl ester [ACD/Index Name]

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

ZINC03432275 [DBID]

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

Density: 1.3±0.1 g/cm3
Boiling Point: 737.8±60.0 °C at 760 mmHg
Vapour Pressure: 0.0±2.4 mmHg at 25°C
Enthalpy of Vaporization: 107.6±3.0 kJ/mol
Flash Point: 400.0±32.9 °C
Index of Refraction: 1.652
Molar Refractivity: 141.9±0.3 cm3
#H bond acceptors: 9
#H bond donors: 1
#Freely Rotating Bonds: 10
#Rule of 5 Violations: 2
ACD/LogP: 5.22
ACD/LogD (pH 5.5): 5.21
ACD/BCF (pH 5.5): 5328.67
ACD/KOC (pH 5.5): 16184.73
ACD/LogD (pH 7.4): 5.21
ACD/BCF (pH 7.4): 5328.61
ACD/KOC (pH 7.4): 16184.57
Polar Surface Area: 113 Å2
Polarizability: 56.3±0.5 10-24cm3
Surface Tension: 55.3±3.0 dyne/cm
Molar Volume: 388.0±3.0 cm3

Click to predict properties on the Chemicalize site


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