ChemSpider 2D Image | Dimethyl 2-{[({[2-(2-methyl-2-propanyl)-1,2,3,4-tetrahydro-9-acridinyl]carbonyl}oxy)acetyl]amino}terephthalate | C30H32N2O7

Dimethyl 2-{[({[2-(2-methyl-2-propanyl)-1,2,3,4-tetrahydro-9-acridinyl]carbonyl}oxy)acetyl]amino}terephthalate

  • Molecular FormulaC30H32N2O7
  • Average mass532.584 Da
  • Monoisotopic mass532.220947 Da
  • ChemSpider ID3789457

More details:

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

1,4-Benzenedicarboxylic acid, 2-[[2-[[[2-(1,1-dimethylethyl)-1,2,3,4-tetrahydro-9-acridinyl]carbonyl]oxy]acetyl]amino]-, dimethyl ester [ACD/Index Name]
2-{[2-({[2-(2-Méthyl-2-propanyl)-1,2,3,4-tétrahydro-9-acridinyl]carbonyl}oxy)acétyl]amino}téréphtalate de diméthyle [French] [ACD/IUPAC Name]
Dimethyl 2-{[({[2-(2-methyl-2-propanyl)-1,2,3,4-tetrahydro-9-acridinyl]carbonyl}oxy)acetyl]amino}terephthalate [ACD/IUPAC Name]
Dimethyl-2-{[({[2-(2-methyl-2-propanyl)-1,2,3,4-tetrahydro-9-acridinyl]carbonyl}oxy)acetyl]amino}terephthalat [German] [ACD/IUPAC 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: 743.2±60.0 °C at 760 mmHg
Vapour Pressure: 0.0±2.5 mmHg at 25°C
Enthalpy of Vaporization: 108.4±3.0 kJ/mol
Flash Point: 403.3±32.9 °C
Index of Refraction: 1.612
Molar Refractivity: 146.3±0.3 cm3
#H bond acceptors: 9
#H bond donors: 1
#Freely Rotating Bonds: 10
#Rule of 5 Violations: 2
ACD/LogP: 7.95
ACD/LogD (pH 5.5): 7.03
ACD/BCF (pH 5.5): 130311.60
ACD/KOC (pH 5.5): 159072.05
ACD/LogD (pH 7.4): 7.04
ACD/BCF (pH 7.4): 131645.56
ACD/KOC (pH 7.4): 160700.42
Polar Surface Area: 121 Å2
Polarizability: 58.0±0.5 10-24cm3
Surface Tension: 55.0±3.0 dyne/cm
Molar Volume: 421.0±3.0 cm3

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