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Search term: MF = 'C_{28}H_{32}O_{7}'
ChemSpider 2D Image | arugosin K | C28H32O7

arugosin K

  • Molecular FormulaC28H32O7
  • Average mass480.549 Da
  • Monoisotopic mass480.214813 Da
  • ChemSpider ID60958429

More details:

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

2-[(7-Hydroxy-2,2-dimethyl-2H-chromen-8-yl)carbonyl]-3-methoxy-5-methyl-6-[(3-methyl-2-buten-1-yl)oxy]benzyl acetate [ACD/IUPAC Name]
2-[(7-Hydroxy-2,2-dimethyl-2H-chromen-8-yl)carbonyl]-3-methoxy-5-methyl-6-[(3-methyl-2-buten-1-yl)oxy]benzyl-acetat [German] [ACD/IUPAC Name]
Acétate de 2-[(7-hydroxy-2,2-diméthyl-2H-chromén-8-yl)carbonyl]-3-méthoxy-5-méthyl-6-[(3-méthyl-2-butén-1-yl)oxy]benzyle [French] [ACD/IUPAC Name]
arugosin K
Methanone, [2-[(acetyloxy)methyl]-6-methoxy-4-methyl-3-[(3-methyl-2-buten-1-yl)oxy]phenyl](7-hydroxy-2,2-dimethyl-2H-1-benzopyran-8-yl)- [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: 645.1±55.0 °C at 760 mmHg
Vapour Pressure: 0.0±2.0 mmHg at 25°C
Enthalpy of Vaporization: 98.6±3.0 kJ/mol
Flash Point: 210.8±25.0 °C
Index of Refraction: 1.560
Molar Refractivity: 133.2±0.3 cm3
#H bond acceptors: 7
#H bond donors: 1
#Freely Rotating Bonds: 9
#Rule of 5 Violations: 1
ACD/LogP: 7.79
ACD/LogD (pH 5.5): 6.37
ACD/BCF (pH 5.5): 40550.34
ACD/KOC (pH 5.5): 68812.90
ACD/LogD (pH 7.4): 5.98
ACD/BCF (pH 7.4): 16508.16
ACD/KOC (pH 7.4): 28013.92
Polar Surface Area: 91 Å2
Polarizability: 52.8±0.5 10-24cm3
Surface Tension: 44.1±3.0 dyne/cm
Molar Volume: 412.1±3.0 cm3

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