ChemSpider 2D Image | 3-Carbamimidamido-4,4-difluorobutanoic acid | C5H9F2N3O2

3-Carbamimidamido-4,4-difluorobutanoic acid

  • Molecular FormulaC5H9F2N3O2
  • Average mass181.141 Da
  • Monoisotopic mass181.066284 Da
  • ChemSpider ID57256244

More details:

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

3-Carbamimidamido-4,4-difluorbutansäure [German] [ACD/IUPAC Name]
3-Carbamimidamido-4,4-difluorobutanoic acid [ACD/IUPAC Name]
Acide 3-carbamimidamido-4,4-difluorobutanoïque [French] [ACD/IUPAC Name]
Butanoic acid, 3-[(aminoiminomethyl)amino]-4,4-difluoro- [ACD/Index Name]
3-{[(Z)-amino(imino)methyl]amino}-4,4-difluorobutanoic acid
MFCD30012190

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

Density: 1.6±0.1 g/cm3
Boiling Point: 310.1±52.0 °C at 760 mmHg
Vapour Pressure: 0.0±1.4 mmHg at 25°C
Enthalpy of Vaporization: 60.6±6.0 kJ/mol
Flash Point: 141.3±30.7 °C
Index of Refraction: 1.519
Molar Refractivity: 33.9±0.5 cm3
#H bond acceptors: 5
#H bond donors: 5
#Freely Rotating Bonds: 5
#Rule of 5 Violations: 1
ACD/LogP: -0.60
ACD/LogD (pH 5.5): -3.15
ACD/BCF (pH 5.5): 1.00
ACD/KOC (pH 5.5): 1.00
ACD/LogD (pH 7.4): -3.16
ACD/BCF (pH 7.4): 1.00
ACD/KOC (pH 7.4): 1.00
Polar Surface Area: 99 Å2
Polarizability: 13.4±0.5 10-24cm3
Surface Tension: 47.5±7.0 dyne/cm
Molar Volume: 111.7±7.0 cm3

Click to predict properties on the Chemicalize site


Advertisement