ChemSpider 2D Image | 3-[3-(Trifluoromethyl)phenyl]propan-1-ol | C10H11F3O

3-[3-(Trifluoromethyl)phenyl]propan-1-ol

  • Molecular FormulaC10H11F3O
  • Average mass204.189 Da
  • Monoisotopic mass204.076202 Da
  • ChemSpider ID11655134

More details:

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

2967776 [Beilstein]
3-(Trifluoromethyl)benzenepropanol
3-(trifluoromethylphenyl)propyl alcohol
3-[3-(Trifluormethyl)phenyl]-1-propanol [German] [ACD/IUPAC Name]
3-[3-(Trifluoromethyl)phenyl]-1-propanol
3-[3-(Trifluorométhyl)phényl]-1-propanol [French] [ACD/IUPAC Name]
3-[3-(Trifluoromethyl)phenyl]propan-1-ol [ACD/IUPAC Name]
616-635-7 [EINECS]
78573-45-2 [RN]
Benzenepropanol, 3-(trifluoromethyl)- [ACD/Index Name]
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Validated by Experts, Validated by Users, Non-Validated, Removed by Users

CCRIS 4693 [DBID]

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

Density: 1.2±0.1 g/cm3
Boiling Point: 236.9±35.0 °C at 760 mmHg
Vapour Pressure: 0.0±0.5 mmHg at 25°C
Enthalpy of Vaporization: 50.1±3.0 kJ/mol
Flash Point: 104.7±17.0 °C
Index of Refraction: 1.465
Molar Refractivity: 47.0±0.3 cm3
#H bond acceptors: 1
#H bond donors: 1
#Freely Rotating Bonds: 4
#Rule of 5 Violations: 0
ACD/LogP: 2.45
ACD/LogD (pH 5.5): 2.71
ACD/BCF (pH 5.5): 68.09
ACD/KOC (pH 5.5): 714.07
ACD/LogD (pH 7.4): 2.71
ACD/BCF (pH 7.4): 68.09
ACD/KOC (pH 7.4): 714.07
Polar Surface Area: 20 Å2
Polarizability: 18.6±0.5 10-24cm3
Surface Tension: 30.1±3.0 dyne/cm
Molar Volume: 169.8±3.0 cm3

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