ChemSpider 2D Image | 1-(4-Acetoxyphenyl)propyl acetate | C13H16O4

1-(4-Acetoxyphenyl)propyl acetate

  • Molecular FormulaC13H16O4
  • Average mass236.264 Da
  • Monoisotopic mass236.104858 Da
  • ChemSpider ID14020535

More details:

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

1-(4-Acetoxyphenyl)propyl acetate [ACD/IUPAC Name]
1-(4-Acetoxyphenyl)propyl-acetat [German] [ACD/IUPAC Name]
1-[4-(Acetyloxy)phenyl]propyl acetate [ACD/IUPAC Name]
129319-15-9 [RN]
1VOY2&R DOV1 [WLN]
4-(Acetyloxy)-α-ethylbenzenemethanol acetate
5339620 [Beilstein]
Acétate de 1-(4-acétoxyphényl)propyle [French] [ACD/IUPAC Name]
Benzenemethanol, 4-(acetyloxy)-α-ethyl-, acetate [ACD/Index Name]
DIHYDROGALANGAL ACETATE
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Validated by Experts, Validated by Users, Non-Validated, Removed by Users

5NKX5Z17DY [DBID]
UNII:5NKX5Z17DY [DBID]

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

Density: 1.1±0.1 g/cm3
Boiling Point: 312.4±25.0 °C at 760 mmHg
Vapour Pressure: 0.0±0.7 mmHg at 25°C
Enthalpy of Vaporization: 55.3±3.0 kJ/mol
Flash Point: 148.9±21.6 °C
Index of Refraction: 1.500
Molar Refractivity: 62.8±0.3 cm3
#H bond acceptors: 4
#H bond donors: 0
#Freely Rotating Bonds: 6
#Rule of 5 Violations: 0
ACD/LogP: 2.14
ACD/LogD (pH 5.5): 2.14
ACD/BCF (pH 5.5): 25.12
ACD/KOC (pH 5.5): 349.71
ACD/LogD (pH 7.4): 2.14
ACD/BCF (pH 7.4): 25.12
ACD/KOC (pH 7.4): 349.71
Polar Surface Area: 53 Å2
Polarizability: 24.9±0.5 10-24cm3
Surface Tension: 37.4±3.0 dyne/cm
Molar Volume: 213.6±3.0 cm3

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