Found 42 results

Search term: MF = 'C_{9}H_{12}FNO_{4}'
ChemSpider 2D Image | trans-1-{[(Allyloxy)carbonyl]amino}-3-fluorocyclobutanecarboxylic acid | C9H12FNO4

trans-1-{[(Allyloxy)carbonyl]amino}-3-fluorocyclobutanecarboxylic acid

  • Molecular FormulaC9H12FNO4
  • Average mass217.194 Da
  • Monoisotopic mass217.075043 Da
  • ChemSpider ID114861522

  • defined stereocentres - 2 of 2 defined stereocentres

More details:

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

Acide trans-1-{[(allyloxy)carbonyl]amino}-3-fluorocyclobutanecarboxylique [French] [ACD/IUPAC Name]
Cyclobutanecarboxylic acid, 3-fluoro-1-[[(2-propen-1-yloxy)carbonyl]amino]-, trans- [ACD/Index Name]
trans-1-{[(Allyloxy)carbonyl]amino}-3-fluorcyclobutancarbonsäure [German] [ACD/IUPAC Name]
trans-1-{[(Allyloxy)carbonyl]amino}-3-fluorocyclobutanecarboxylic acid [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: 375.8±42.0 °C at 760 mmHg
Vapour Pressure: 0.0±1.8 mmHg at 25°C
Enthalpy of Vaporization: 68.4±6.0 kJ/mol
Flash Point: 181.1±27.9 °C
Index of Refraction: 1.498
Molar Refractivity: 48.7±0.4 cm3
#H bond acceptors: 5
#H bond donors: 2
#Freely Rotating Bonds: 5
#Rule of 5 Violations: 0
ACD/LogP: 0.77
ACD/LogD (pH 5.5): -1.32
ACD/BCF (pH 5.5): 1.00
ACD/KOC (pH 5.5): 1.00
ACD/LogD (pH 7.4): -2.85
ACD/BCF (pH 7.4): 1.00
ACD/KOC (pH 7.4): 1.00
Polar Surface Area: 76 Å2
Polarizability: 19.3±0.5 10-24cm3
Surface Tension: 44.6±5.0 dyne/cm
Molar Volume: 166.1±5.0 cm3

Click to predict properties on the Chemicalize site


Advertisement