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Search term: CAFMEFBXDAOXDX-UHFFFAOYSA-N (Found by InChIKey (full match))
ChemSpider 2D Image | 2-[(Adamantan-1-ylamino)methyl]-5-fluorophenol | C17H22FNO

2-[(Adamantan-1-ylamino)methyl]-5-fluorophenol

  • Molecular FormulaC17H22FNO
  • Average mass275.361 Da
  • Monoisotopic mass275.168549 Da
  • ChemSpider ID29410769

More details:

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

2-[(Adamantan-1-ylamino)methyl]-5-fluorophenol [ACD/IUPAC Name]
2-[(Adamantan-1-ylamino)méthyl]-5-fluorophénol [French] [ACD/IUPAC Name]
2-[(Adamantan-1-ylamino)methyl]-5-fluorphenol [German] [ACD/IUPAC Name]
Phenol, 5-fluoro-2-[(tricyclo[3.3.1.13,7]dec-1-ylamino)methyl]- [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: 403.1±30.0 °C at 760 mmHg
Vapour Pressure: 0.0±1.0 mmHg at 25°C
Enthalpy of Vaporization: 68.0±3.0 kJ/mol
Flash Point: 197.6±24.6 °C
Index of Refraction: 1.596
Molar Refractivity: 76.8±0.4 cm3
#H bond acceptors: 2
#H bond donors: 2
#Freely Rotating Bonds: 3
#Rule of 5 Violations: 0
ACD/LogP: 4.11
ACD/LogD (pH 5.5): 0.99
ACD/BCF (pH 5.5): 1.00
ACD/KOC (pH 5.5): 3.25
ACD/LogD (pH 7.4): 1.64
ACD/BCF (pH 7.4): 2.74
ACD/KOC (pH 7.4): 14.67
Polar Surface Area: 32 Å2
Polarizability: 30.4±0.5 10-24cm3
Surface Tension: 49.0±5.0 dyne/cm
Molar Volume: 225.7±5.0 cm3

Click to predict properties on the Chemicalize site


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