ChemSpider 2D Image | N'-(pyrrolidine-1-carboximidoyl)-N-[4-(trifluoromethoxy)phenyl]guanidine | C13H16F3N5O

N'-(pyrrolidine-1-carboximidoyl)-N-[4-(trifluoromethoxy)phenyl]guanidine

  • Molecular FormulaC13H16F3N5O
  • Average mass315.294 Da
  • Monoisotopic mass315.130707 Da
  • ChemSpider ID92169512

More details:

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

1422365-93-2 [RN]
1-Pyrrolidinecarboximidamide, N-[imino[[4-(trifluoromethoxy)phenyl]amino]methyl]- [ACD/Index Name]
N'-(pyrrolidine-1-carboximidoyl)-N-[4-(trifluoromethoxy)phenyl]guanidine
N-{N-[4-(Trifluormethoxy)phenyl]carbamimidoyl}-1-pyrrolidincarboximidamid [German] [ACD/IUPAC Name]
N-{N-[4-(Trifluoromethoxy)phenyl]carbamimidoyl}-1-pyrrolidinecarboximidamide [ACD/IUPAC Name]
N-{N-[4-(Trifluorométhoxy)phényl]carbamimidoyl}-1-pyrrolidinecarboximidamide [French] [ACD/IUPAC Name]
IM156
Lixumistat
MFCD32856762
N-(N-(4-(Trifluoromethoxy)phenyl)carbamimidoyl)pyrrolidine-1-carboximidamide
More...

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

Density: 1.4±0.1 g/cm3
Boiling Point: 337.2±52.0 °C at 760 mmHg
Vapour Pressure: 0.0±0.7 mmHg at 25°C
Enthalpy of Vaporization: 58.0±3.0 kJ/mol
Flash Point: 157.8±30.7 °C
Index of Refraction: 1.578
Molar Refractivity: 72.8±0.5 cm3
#H bond acceptors: 6
#H bond donors: 4
#Freely Rotating Bonds: 7
#Rule of 5 Violations: 0
ACD/LogP: 0.96
ACD/LogD (pH 5.5): -0.25
ACD/BCF (pH 5.5): 1.00
ACD/KOC (pH 5.5): 2.17
ACD/LogD (pH 7.4): 0.28
ACD/BCF (pH 7.4): 1.00
ACD/KOC (pH 7.4): 7.37
Polar Surface Area: 84 Å2
Polarizability: 28.9±0.5 10-24cm3
Surface Tension: 45.4±7.0 dyne/cm
Molar Volume: 219.2±7.0 cm3

Click to predict properties on the Chemicalize site


Advertisement