ChemSpider 2D Image | (3Z)-3-{[2-(2,3-Dimethyl-2-oxiranyl)-6,8-dimethyl-1,2,4a,5,6,7,8,8a-octahydro-1-naphthalenyl](hydroxy)methylene}-5-isopropyl-1-methyl-2,4-pyrrolidinedione | C25H37NO4

(3Z)-3-{[2-(2,3-Dimethyl-2-oxiranyl)-6,8-dimethyl-1,2,4a,5,6,7,8,8a-octahydro-1-naphthalenyl](hydroxy)methylene}-5-isopropyl-1-methyl-2,4-pyrrolidinedione

  • Molecular FormulaC25H37NO4
  • Average mass415.566 Da
  • Monoisotopic mass415.272247 Da
  • ChemSpider ID57260857

  • Double-bond stereo - Double-bond stereo

More details:

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

(3Z)-3-{[2-(2,3-Diméthyl-2-oxiranyl)-6,8-diméthyl-1,2,4a,5,6,7,8,8a-octahydro-1-naphtalényl](hydroxy)méthylène}-5-isopropyl-1-méthyl-2,4-pyrrolidinedione [French] [ACD/IUPAC Name]
(3Z)-3-{[2-(2,3-Dimethyl-2-oxiranyl)-6,8-dimethyl-1,2,4a,5,6,7,8,8a-octahydro-1-naphthalenyl](hydroxy)methylene}-5-isopropyl-1-methyl-2,4-pyrrolidinedione [ACD/IUPAC Name]
(3Z)-3-{[2-(2,3-Dimethyl-2-oxiranyl)-6,8-dimethyl-1,2,4a,5,6,7,8,8a-octahydro-1-naphthalinyl](hydroxy)methylen}-5-isopropyl-1-methyl-2,4-pyrrolidindion [German] [ACD/IUPAC Name]
2,4-Pyrrolidinedione, 3-[[2-(2,3-dimethyloxiranyl)-1,2,4a,5,6,7,8,8a-octahydro-6,8-dimethyl-1-naphthalenyl]hydroxymethylene]-1-methyl-5-(1-methylethyl)-, (3Z)- [ACD/Index Name]
122301-98-8 [RN]
Vermisporin

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

Density: 1.1±0.1 g/cm3
Boiling Point: 560.1±50.0 °C at 760 mmHg
Vapour Pressure: 0.0±3.5 mmHg at 25°C
Enthalpy of Vaporization: 96.8±6.0 kJ/mol
Flash Point: 292.6±30.1 °C
Index of Refraction: 1.536
Molar Refractivity: 116.0±0.3 cm3
#H bond acceptors: 5
#H bond donors: 1
#Freely Rotating Bonds: 3
#Rule of 5 Violations: 0
ACD/LogP: 4.14
ACD/LogD (pH 5.5): 2.78
ACD/BCF (pH 5.5): 43.13
ACD/KOC (pH 5.5): 260.75
ACD/LogD (pH 7.4): 1.02
ACD/BCF (pH 7.4): 1.00
ACD/KOC (pH 7.4): 4.50
Polar Surface Area: 70 Å2
Polarizability: 46.0±0.5 10-24cm3
Surface Tension: 39.7±3.0 dyne/cm
Molar Volume: 371.9±3.0 cm3

Click to predict properties on the Chemicalize site


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