ChemSpider 2D Image | 5-[4-(HEPTYLOXY)BENZOYL]-2-METHYLPYRIDINE | C20H25NO2

5-[4-(HEPTYLOXY)BENZOYL]-2-METHYLPYRIDINE

  • Molecular FormulaC20H25NO2
  • Average mass311.418 Da
  • Monoisotopic mass311.188538 Da
  • ChemSpider ID27525635

More details:

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

[4-(Heptyloxy)phenyl](6-methyl-3-pyridinyl)methanon [German] [ACD/IUPAC Name]
[4-(Heptyloxy)phenyl](6-methyl-3-pyridinyl)methanone [ACD/IUPAC Name]
[4-(Heptyloxy)phényl](6-méthyl-3-pyridinyl)méthanone [French] [ACD/IUPAC Name]
1187169-21-6 [RN]
5-[4-(HEPTYLOXY)BENZOYL]-2-METHYLPYRIDINE
Methanone, [4-(heptyloxy)phenyl](6-methyl-3-pyridinyl)- [ACD/Index Name]
(4-(Heptyloxy)phenyl)(6-methylpyridin-3-yl)methanone
(4-heptoxyphenyl)-(6-methylpyridin-3-yl)methanone
5-(4-Heptyloxybenzoyl)-2-methylpyridine
MFCD13153245 [MDL number]

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

Density: 1.0±0.1 g/cm3
Boiling Point: 459.6±35.0 °C at 760 mmHg
Vapour Pressure: 0.0±1.1 mmHg at 25°C
Enthalpy of Vaporization: 72.0±3.0 kJ/mol
Flash Point: 231.8±25.9 °C
Index of Refraction: 1.535
Molar Refractivity: 93.4±0.3 cm3
#H bond acceptors: 3
#H bond donors: 0
#Freely Rotating Bonds: 9
#Rule of 5 Violations: 1
ACD/LogP: 5.58
ACD/LogD (pH 5.5): 5.62
ACD/BCF (pH 5.5): 10889.89
ACD/KOC (pH 5.5): 26849.37
ACD/LogD (pH 7.4): 5.63
ACD/BCF (pH 7.4): 11097.11
ACD/KOC (pH 7.4): 27360.27
Polar Surface Area: 39 Å2
Polarizability: 37.0±0.5 10-24cm3
Surface Tension: 39.9±3.0 dyne/cm
Molar Volume: 300.1±3.0 cm3

Click to predict properties on the Chemicalize site


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