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Search term: OXXWZHKBQVSZRB-UHFFFAOYSA-N (Found by InChIKey (full match))
ChemSpider 2D Image | N-Cyano-N'-(3-{4-[3-(trifluoromethyl)phenyl]-1-piperazinyl}propyl)-2-pyridinecarboximidamide | C21H23F3N6

N-Cyano-N'-(3-{4-[3-(trifluoromethyl)phenyl]-1-piperazinyl}propyl)-2-pyridinecarboximidamide

  • Molecular FormulaC21H23F3N6
  • Average mass416.443 Da
  • Monoisotopic mass416.193634 Da
  • ChemSpider ID28430296

More details:

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

2-Pyridinecarboximidamide, N'-cyano-N-[3-[4-[3-(trifluoromethyl)phenyl]-1-piperazinyl]propyl]- [ACD/Index Name]
N-Cyan-N'-(3-{4-[3-(trifluormethyl)phenyl]-1-piperazinyl}propyl)-2-pyridincarboximidamid [German] [ACD/IUPAC Name]
N-Cyano-N'-(3-{4-[3-(trifluoromethyl)phenyl]-1-piperazinyl}propyl)-2-pyridinecarboximidamide [ACD/IUPAC Name]
N-Cyano-N'-(3-{4-[3-(trifluorométhyl)phényl]-1-pipérazinyl}propyl)-2-pyridinecarboximidamide [French] [ACD/IUPAC Name]

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

Density: 1.3±0.1 g/cm3
Boiling Point: 545.4±60.0 °C at 760 mmHg
Vapour Pressure: 0.0±1.5 mmHg at 25°C
Enthalpy of Vaporization: 82.4±3.0 kJ/mol
Flash Point: 283.6±32.9 °C
Index of Refraction: 1.583
Molar Refractivity: 110.8±0.5 cm3
#H bond acceptors: 6
#H bond donors: 1
#Freely Rotating Bonds: 9
#Rule of 5 Violations: 0
ACD/LogP: 3.80
ACD/LogD (pH 5.5): 1.71
ACD/BCF (pH 5.5): 5.25
ACD/KOC (pH 5.5): 44.06
ACD/LogD (pH 7.4): 3.03
ACD/BCF (pH 7.4): 110.03
ACD/KOC (pH 7.4): 924.05
Polar Surface Area: 68 Å2
Polarizability: 43.9±0.5 10-24cm3
Surface Tension: 43.4±7.0 dyne/cm
Molar Volume: 331.5±7.0 cm3

Click to predict properties on the Chemicalize site


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