Found 4 results

Search term: MF = 'C_{41}H_{62}O_{3}'
ChemSpider 2D Image | 1'-Hydroxy-1-methoxy-1,1',2,2',7',8'-hexahydro-psi,psi-caroten-4-one | C41H62O3

1'-Hydroxy-1-methoxy-1,1',2,2',7',8'-hexahydro-ψ,ψ-caroten-4-one

  • Molecular FormulaC41H62O3
  • Average mass602.929 Da
  • Monoisotopic mass602.469910 Da
  • ChemSpider ID59700405

  • Double-bond stereo - Double-bond stereo

More details:

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

1'-Hydroxy-1-methoxy-1,1',2,2',7',8'-hexahydro-ψ,ψ-caroten-4-one [ACD/IUPAC Name]
1'-Hydroxy-1-méthoxy-1,1',2,2',7',8'-hexahydro-ψ,ψ-carotén-4-one [French] [ACD/IUPAC Name]
1'-Hydroxy-1-methoxy-1,1',2,2',7',8'-hexahydro-ψ,ψ-carotin-4-on [German] [ACD/IUPAC Name]
ψ,ψ-Caroten-4-one, 1,1',2,2',7',8'-hexahydro-1'-hydroxy-1-methoxy- [ACD/Index Name]
1'-Hydroxy-1-methoxy-1,2,1',2',7',8'-hexahydro-ψ,ψ-caroten-4-one
1-Methoxy-1'-hydroxy-1,2,1',2',7',8'-hexahydro-ψ,ψ-caroten-4-on
R.g.Keto-VII

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

Density: 0.9±0.1 g/cm3
Boiling Point: 722.9±55.0 °C at 760 mmHg
Vapour Pressure: 0.0±5.3 mmHg at 25°C
Enthalpy of Vaporization: 120.6±6.0 kJ/mol
Flash Point: 207.9±25.0 °C
Index of Refraction: 1.520
Molar Refractivity: 194.9±0.3 cm3
#H bond acceptors: 3
#H bond donors: 1
#Freely Rotating Bonds: 20
#Rule of 5 Violations: 2
ACD/LogP: 10.99
ACD/LogD (pH 5.5): 10.32
ACD/BCF (pH 5.5): 1000000.00
ACD/KOC (pH 5.5): 9754454.00
ACD/LogD (pH 7.4): 10.32
ACD/BCF (pH 7.4): 1000000.00
ACD/KOC (pH 7.4): 9754454.00
Polar Surface Area: 47 Å2
Polarizability: 77.3±0.5 10-24cm3
Surface Tension: 33.6±3.0 dyne/cm
Molar Volume: 641.4±3.0 cm3

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