ChemSpider 2D Image | 2,4-Dinitrophenyl 4-[bis(4-methoxyphenyl)(phenyl)methoxy]butanoate | C31H28N2O9

2,4-Dinitrophenyl 4-[bis(4-methoxyphenyl)(phenyl)methoxy]butanoate

  • Molecular FormulaC31H28N2O9
  • Average mass572.562 Da
  • Monoisotopic mass572.179504 Da
  • ChemSpider ID115070

More details:

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

2,4-Dinitrophenyl 4-[bis(4-methoxyphenyl)(phenyl)methoxy]butanoate [ACD/IUPAC Name]
2,4-Dinitrophenyl-4-[bis(4-methoxyphenyl)(phenyl)methoxy]butanoat [German] [ACD/IUPAC Name]
4-[Bis(4-méthoxyphényl)(phényl)méthoxy]butanoate de 2,4-dinitrophényle [French] [ACD/IUPAC Name]
Butanoic acid, 4-(bis(4-methoxyphenyl)phenylmethoxy)-, 2,4-dinitrophenyl ester
Butanoic acid, 4-[bis(4-methoxyphenyl)phenylmethoxy]-, 2,4-dinitrophenyl ester [ACD/Index Name]
123658-23-1 [RN]
2,4-Dinitrophenyl-4-O-(4,4'-dimethoxytrityl)butyrate
DDTB

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

Density: 1.3±0.1 g/cm3
Boiling Point: 704.1±60.0 °C at 760 mmHg
Vapour Pressure: 0.0±2.2 mmHg at 25°C
Enthalpy of Vaporization: 103.0±3.0 kJ/mol
Flash Point: 247.9±34.9 °C
Index of Refraction: 1.606
Molar Refractivity: 152.5±0.3 cm3
#H bond acceptors: 11
#H bond donors: 0
#Freely Rotating Bonds: 14
#Rule of 5 Violations: 3
ACD/LogP: 7.64
ACD/LogD (pH 5.5): 6.55
ACD/BCF (pH 5.5): 55681.98
ACD/KOC (pH 5.5): 86808.91
ACD/LogD (pH 7.4): 6.55
ACD/BCF (pH 7.4): 55681.98
ACD/KOC (pH 7.4): 86808.91
Polar Surface Area: 146 Å2
Polarizability: 60.5±0.5 10-24cm3
Surface Tension: 51.4±3.0 dyne/cm
Molar Volume: 442.4±3.0 cm3

Click to predict properties on the Chemicalize site


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