ChemSpider 2D Image | 3-[4-Hydroxy-3,5-bis(2-methyl-2-propanyl)benzylidene]-1-methoxy-2-pyrrolidinone | C20H29NO3

3-[4-Hydroxy-3,5-bis(2-methyl-2-propanyl)benzylidene]-1-methoxy-2-pyrrolidinone

  • Molecular FormulaC20H29NO3
  • Average mass331.449 Da
  • Monoisotopic mass331.214752 Da
  • ChemSpider ID26535733

More details:

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

107746-52-1 [RN]
2-Pyrrolidinone, 3-[[3,5-bis(1,1-dimethylethyl)-4-hydroxyphenyl]methylene]-1-methoxy- [ACD/Index Name]
3-[[3,5-Bis(1,1-dimethylethyl)-4-hydroxyphenyl]methylene]-1-methoxy-2-pyrrolidinone
3-[4-Hydroxy-3,5-bis(2-methyl-2-propanyl)benzyliden]-1-methoxy-2-pyrrolidinon [German] [ACD/IUPAC Name]
3-[4-Hydroxy-3,5-bis(2-methyl-2-propanyl)benzylidene]-1-methoxy-2-pyrrolidinone [ACD/IUPAC Name]
3-[4-Hydroxy-3,5-bis(2-méthyl-2-propanyl)benzylidène]-1-méthoxy-2-pyrrolidinone [French] [ACD/IUPAC Name]
3-[(3,5-Ditert-butyl-4-hydroxyphenyl)methylidene]-1-methoxypyrrolidin-2-one
N-methoxy-3-(3,5-dit-butyl-4-hydroxybenzylidene)-2-pyrrolidone

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

Density: 1.1±0.1 g/cm3
Boiling Point: 409.2±55.0 °C at 760 mmHg
Vapour Pressure: 0.0±1.0 mmHg at 25°C
Enthalpy of Vaporization: 68.7±3.0 kJ/mol
Flash Point: 201.2±31.5 °C
Index of Refraction: 1.556
Molar Refractivity: 96.5±0.4 cm3
#H bond acceptors: 4
#H bond donors: 1
#Freely Rotating Bonds: 4
#Rule of 5 Violations: 0
ACD/LogP: 4.99
ACD/LogD (pH 5.5): 4.51
ACD/BCF (pH 5.5): 1566.84
ACD/KOC (pH 5.5): 6739.02
ACD/LogD (pH 7.4): 4.51
ACD/BCF (pH 7.4): 1566.79
ACD/KOC (pH 7.4): 6738.79
Polar Surface Area: 50 Å2
Polarizability: 38.2±0.5 10-24cm3
Surface Tension: 44.5±5.0 dyne/cm
Molar Volume: 300.0±5.0 cm3

Click to predict properties on the Chemicalize site


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