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Search term: RLNKXFUKNFUIHO-UHFFFAOYSA-N (Found by InChIKey (full match))
ChemSpider 2D Image | [5-(Trifluoromethyl)-1H-indol-3-yl]acetonitrile | C11H7F3N2

[5-(Trifluoromethyl)-1H-indol-3-yl]acetonitrile

  • Molecular FormulaC11H7F3N2
  • Average mass224.182 Da
  • Monoisotopic mass224.056137 Da
  • ChemSpider ID24589084

More details:

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

[5-(Trifluormethyl)-1H-indol-3-yl]acetonitril [German] [ACD/IUPAC Name]
[5-(Trifluoromethyl)-1H-indol-3-yl]acetonitrile [ACD/IUPAC Name]
[5-(Trifluorométhyl)-1H-indol-3-yl]acétonitrile [French] [ACD/IUPAC Name]
1H-Indole-3-acetonitrile, 5-(trifluoromethyl)- [ACD/Index Name]
2-(5-(Trifluoromethyl)-1H-indol-3-yl)acetonitrile
2-[5-(Trifluoromethyl)indol-3-yl]acetonitrile
5-(Trifluoromethyl)indole-3-acetonitrile
959236-26-1 [RN]

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

Density: 1.4±0.1 g/cm3
Boiling Point: 368.3±37.0 °C at 760 mmHg
Vapour Pressure: 0.0±0.8 mmHg at 25°C
Enthalpy of Vaporization: 61.5±3.0 kJ/mol
Flash Point: 176.5±26.5 °C
Index of Refraction: 1.569
Molar Refractivity: 53.0±0.3 cm3
#H bond acceptors: 2
#H bond donors: 1
#Freely Rotating Bonds: 3
#Rule of 5 Violations: 0
ACD/LogP: 1.95
ACD/LogD (pH 5.5): 2.82
ACD/BCF (pH 5.5): 82.46
ACD/KOC (pH 5.5): 818.99
ACD/LogD (pH 7.4): 2.82
ACD/BCF (pH 7.4): 82.46
ACD/KOC (pH 7.4): 818.99
Polar Surface Area: 40 Å2
Polarizability: 21.0±0.5 10-24cm3
Surface Tension: 42.6±3.0 dyne/cm
Molar Volume: 161.6±3.0 cm3

Click to predict properties on the Chemicalize site


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