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Search term: PDBZVLNUNOGADS (Found by InChIKey (skeleton match))

ChemSpider 2D Image | 3-[2-(Dibutylamino)cyclopropyl]phenol | C17H27NO

3-[2-(Dibutylamino)cyclopropyl]phenol

  • Molecular FormulaC17H27NO
  • Average mass261.402 Da
  • Monoisotopic mass261.209259 Da
  • ChemSpider ID23242929

More details:






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

3-[2-(Dibutylamino)cyclopropyl]phenol [ACD/IUPAC Name]
3-[2-(Dibutylamino)cyclopropyl]phenol [German] [ACD/IUPAC Name]
3-[2-(Dibutylamino)cyclopropyl]phénol [French] [ACD/IUPAC Name]
Phenol, 3-[2-(dibutylamino)cyclopropyl]- [ACD/Index Name]
3-(2-Dibutylamino-cyclopropyl)-phenol

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

Density: 1.0±0.1 g/cm3
Boiling Point: 382.8±42.0 °C at 760 mmHg
Vapour Pressure: 0.0±0.9 mmHg at 25°C
Enthalpy of Vaporization: 65.6±3.0 kJ/mol
Flash Point: 169.3±26.5 °C
Index of Refraction: 1.544
Molar Refractivity: 81.0±0.4 cm3
#H bond acceptors: 2
#H bond donors: 1
#Freely Rotating Bonds: 8
#Rule of 5 Violations: 0
ACD/LogP: 4.38
ACD/LogD (pH 5.5): 0.97
ACD/BCF (pH 5.5): 1.00
ACD/KOC (pH 5.5): 3.91
ACD/LogD (pH 7.4): 2.46
ACD/BCF (pH 7.4): 20.34
ACD/KOC (pH 7.4): 121.52
Polar Surface Area: 23 Å2
Polarizability: 32.1±0.5 10-24cm3
Surface Tension: 41.9±5.0 dyne/cm
Molar Volume: 256.5±5.0 cm3

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