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Search term: OEIKGQLRHZSEKK-UCLBXIDTSA-N (Found by InChIKey (full match))
ChemSpider 2D Image | 4-[(E)-(1s,5s)-Bicyclo[3.3.1]non-9-ylidene(phenyl)methyl]phenol | C22H24O

4-[(E)-(1s,5s)-Bicyclo[3.3.1]non-9-ylidene(phenyl)methyl]phenol

  • Molecular FormulaC22H24O
  • Average mass304.425 Da
  • Monoisotopic mass304.182709 Da
  • ChemSpider ID61708925

  • Double-bond stereo - Double-bond stereo

    defined stereocentres - 2 of 2 defined stereocentres

More details:

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

4-[(E)-(1s,5s)-Bicyclo[3.3.1]non-9-yliden(phenyl)methyl]phenol [German] [ACD/IUPAC Name]
4-[(E)-(1s,5s)-Bicyclo[3.3.1]non-9-ylidene(phenyl)methyl]phenol [ACD/IUPAC Name]
4-[(E)-(1s,5s)-Bicyclo[3.3.1]non-9-ylidène(phényl)méthyl]phénol [French] [ACD/IUPAC Name]
4-[(Z)-(1s,5s)-Bicyclo[3.3.1]non-9-yliden(phenyl)methyl]phenol [German] [ACD/IUPAC Name]
4-[(Z)-(1s,5s)-Bicyclo[3.3.1]non-9-ylidene(phenyl)methyl]phenol [ACD/IUPAC Name]
4-[(Z)-(1s,5s)-Bicyclo[3.3.1]non-9-ylidène(phényl)méthyl]phénol [French] [ACD/IUPAC Name]
Phenol, 4-[(E)-bicyclo[3.3.1]non-9-ylidenephenylmethyl]- [ACD/Index Name]
Phenol, 4-[(Z)-bicyclo[3.3.1]non-9-ylidenephenylmethyl]- [ACD/Index Name]
5HX

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

Density: 1.1±0.1 g/cm3
Boiling Point: 464.4±14.0 °C at 760 mmHg
Vapour Pressure: 0.0±1.2 mmHg at 25°C
Enthalpy of Vaporization: 75.4±3.0 kJ/mol
Flash Point: 218.7±12.0 °C
Index of Refraction: 1.613
Molar Refractivity: 95.1±0.3 cm3
#H bond acceptors: 1
#H bond donors: 1
#Freely Rotating Bonds: 2
#Rule of 5 Violations: 1
ACD/LogP: 7.47
ACD/LogD (pH 5.5): 6.63
ACD/BCF (pH 5.5): 64351.68
ACD/KOC (pH 5.5): 96281.84
ACD/LogD (pH 7.4): 6.63
ACD/BCF (pH 7.4): 64202.77
ACD/KOC (pH 7.4): 96059.04
Polar Surface Area: 20 Å2
Polarizability: 37.7±0.5 10-24cm3
Surface Tension: 45.6±3.0 dyne/cm
Molar Volume: 273.4±3.0 cm3

Click to predict properties on the Chemicalize site


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