ChemSpider 2D Image | 2-Methoxy-5-[(1E)-3-(2-naphthyl)-3-oxo-1-propen-1-yl]phenyl [4-methyl-2-(2-methyl-2-propanyl)phenoxy]acetate | C33H32O5

2-Methoxy-5-[(1E)-3-(2-naphthyl)-3-oxo-1-propen-1-yl]phenyl [4-methyl-2-(2-methyl-2-propanyl)phenoxy]acetate

  • Molecular FormulaC33H32O5
  • Average mass508.604 Da
  • Monoisotopic mass508.224976 Da
  • ChemSpider ID126729608

  • Double-bond stereo - Double-bond stereo

More details:

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

[4-Méthyl-2-(2-méthyl-2-propanyl)phénoxy]acétate de 2-méthoxy-5-[(1E)-3-(2-naphtyl)-3-oxo-1-propén-1-yl]phényle [French] [ACD/IUPAC Name]
2-Methoxy-5-[(1E)-3-(2-naphthyl)-3-oxo-1-propen-1-yl]phenyl [4-methyl-2-(2-methyl-2-propanyl)phenoxy]acetate [ACD/IUPAC Name]
2-Methoxy-5-[(1E)-3-(2-naphthyl)-3-oxo-1-propen-1-yl]phenyl-[4-methyl-2-(2-methyl-2-propanyl)phenoxy]acetat [German] [ACD/IUPAC Name]
Acetic acid, 2-[2-(1,1-dimethylethyl)-4-methylphenoxy]-, 2-methoxy-5-[(1E)-3-(2-naphthalenyl)-3-oxo-1-propen-1-yl]phenyl ester [ACD/Index Name]

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

Density: 1.2±0.1 g/cm3
Boiling Point: 675.8±55.0 °C at 760 mmHg
Vapour Pressure: 0.0±2.1 mmHg at 25°C
Enthalpy of Vaporization: 99.2±3.0 kJ/mol
Flash Point: 344.5±19.5 °C
Index of Refraction: 1.615
Molar Refractivity: 152.4±0.3 cm3
#H bond acceptors: 5
#H bond donors: 0
#Freely Rotating Bonds: 10
#Rule of 5 Violations: 2
ACD/LogP: 8.20
ACD/LogD (pH 5.5): 7.53
ACD/BCF (pH 5.5): 311287.84
ACD/KOC (pH 5.5): 297563.31
ACD/LogD (pH 7.4): 7.53
ACD/BCF (pH 7.4): 311287.84
ACD/KOC (pH 7.4): 297563.31
Polar Surface Area: 62 Å2
Polarizability: 60.4±0.5 10-24cm3
Surface Tension: 44.8±3.0 dyne/cm
Molar Volume: 436.9±3.0 cm3

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