Found 290 results

Search term: MF = 'C_{28}H_{28}O_{5}'
ChemSpider 2D Image | Butyl 2-(6-butoxy-3-oxo-3H-xanthen-9-yl)benzoate | C28H28O5

Butyl 2-(6-butoxy-3-oxo-3H-xanthen-9-yl)benzoate

  • Molecular FormulaC28H28O5
  • Average mass444.519 Da
  • Monoisotopic mass444.193665 Da
  • ChemSpider ID28681032

More details:

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

2-(6-Butoxy-3-oxo-3H-xanthén-9-yl)benzoate de butyle [French] [ACD/IUPAC Name]
Benzoic acid, 2-(6-butoxy-3-oxo-3H-xanthen-9-yl)-, butyl ester [ACD/Index Name]
Butyl 2-(6-butoxy-3-oxo-3H-xanthen-9-yl)benzoate [ACD/IUPAC Name]
Butyl-2-(6-butoxy-3-oxo-3H-xanthen-9-yl)benzoat [German] [ACD/IUPAC Name]
131205-61-3 [RN]
BUTYL 2-(3-BUTOXY-6-OXOXANTHEN-9-YL)BENZOATE

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

Density: 1.2±0.1 g/cm3
Boiling Point: 635.6±55.0 °C at 760 mmHg
Vapour Pressure: 0.0±1.9 mmHg at 25°C
Enthalpy of Vaporization: 93.9±3.0 kJ/mol
Flash Point: 337.5±19.5 °C
Index of Refraction: 1.611
Molar Refractivity: 126.0±0.4 cm3
#H bond acceptors: 5
#H bond donors: 0
#Freely Rotating Bonds: 10
#Rule of 5 Violations: 1
ACD/LogP: 6.89
ACD/LogD (pH 5.5): 6.29
ACD/BCF (pH 5.5): 35341.81
ACD/KOC (pH 5.5): 62697.30
ACD/LogD (pH 7.4): 6.29
ACD/BCF (pH 7.4): 35341.81
ACD/KOC (pH 7.4): 62697.30
Polar Surface Area: 62 Å2
Polarizability: 49.9±0.5 10-24cm3
Surface Tension: 52.5±5.0 dyne/cm
Molar Volume: 363.0±5.0 cm3

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