ChemSpider 2D Image | (3R,4R)-1-(3-Methylphenyl)-2,5-dioxo-3,4-pyrrolidinediyl diacetate | C15H15NO6

(3R,4R)-1-(3-Methylphenyl)-2,5-dioxo-3,4-pyrrolidinediyl diacetate

  • Molecular FormulaC15H15NO6
  • Average mass305.283 Da
  • Monoisotopic mass305.089935 Da
  • ChemSpider ID24742522

  • defined stereocentres - 2 of 2 defined stereocentres

More details:

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

(3R,4R)-1-(3-Methylphenyl)-2,5-dioxo-3,4-pyrrolidindiyl-diacetat [German] [ACD/IUPAC Name]
(3R,4R)-1-(3-Methylphenyl)-2,5-dioxo-3,4-pyrrolidinediyl diacetate [ACD/IUPAC Name]
2,5-Pyrrolidinedione, 3,4-bis(acetyloxy)-1-(3-methylphenyl)-, (3R,4R)- [ACD/Index Name]
Diacétate de (3R,4R)-1-(3-méthylphényl)-2,5-dioxo-3,4-pyrrolidinediyle [French] [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: 511.4±50.0 °C at 760 mmHg
Vapour Pressure: 0.0±1.3 mmHg at 25°C
Enthalpy of Vaporization: 78.2±3.0 kJ/mol
Flash Point: 263.1±30.1 °C
Index of Refraction: 1.568
Molar Refractivity: 74.2±0.4 cm3
#H bond acceptors: 7
#H bond donors: 0
#Freely Rotating Bonds: 5
#Rule of 5 Violations: 0
ACD/LogP: 0.93
ACD/LogD (pH 5.5): 0.67
ACD/BCF (pH 5.5): 1.89
ACD/KOC (pH 5.5): 54.96
ACD/LogD (pH 7.4): 0.67
ACD/BCF (pH 7.4): 1.89
ACD/KOC (pH 7.4): 54.96
Polar Surface Area: 90 Å2
Polarizability: 29.4±0.5 10-24cm3
Surface Tension: 54.8±5.0 dyne/cm
Molar Volume: 226.6±5.0 cm3

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