ChemSpider 2D Image | [trans-3-Fluoro-1-({[(2-methyl-2-propanyl)oxy]carbonyl}amino)cyclobutyl](hydroxy)acetic acid | C11H18FNO5

[trans-3-Fluoro-1-({[(2-methyl-2-propanyl)oxy]carbonyl}amino)cyclobutyl](hydroxy)acetic acid

  • Molecular FormulaC11H18FNO5
  • Average mass263.263 Da
  • Monoisotopic mass263.116913 Da
  • ChemSpider ID75225246

  • defined stereocentres - 2 of 3 defined stereocentres

More details:

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

[trans-3-Fluor-1-({[(2-methyl-2-propanyl)oxy]carbonyl}amino)cyclobutyl](hydroxy)essigsäure [German] [ACD/IUPAC Name]
[trans-3-Fluoro-1-({[(2-methyl-2-propanyl)oxy]carbonyl}amino)cyclobutyl](hydroxy)acetic acid [ACD/IUPAC Name]
Acide [trans-3-fluoro-1-({[(2-méthyl-2-propanyl)oxy]carbonyl}amino)cyclobutyl](hydroxy)acétique [French] [ACD/IUPAC Name]
Cyclobutaneacetic acid, 1-[[(1,1-dimethylethoxy)carbonyl]amino]-3-fluoro-α-hydroxy-, trans- [ACD/Index 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: 436.5±35.0 °C at 760 mmHg
Vapour Pressure: 0.0±2.4 mmHg at 25°C
Enthalpy of Vaporization: 80.0±6.0 kJ/mol
Flash Point: 217.8±25.9 °C
Index of Refraction: 1.503
Molar Refractivity: 59.7±0.4 cm3
#H bond acceptors: 6
#H bond donors: 3
#Freely Rotating Bonds: 5
#Rule of 5 Violations: 0
ACD/LogP: 1.08
ACD/LogD (pH 5.5): -1.33
ACD/BCF (pH 5.5): 1.00
ACD/KOC (pH 5.5): 1.00
ACD/LogD (pH 7.4): -2.62
ACD/BCF (pH 7.4): 1.00
ACD/KOC (pH 7.4): 1.00
Polar Surface Area: 96 Å2
Polarizability: 23.7±0.5 10-24cm3
Surface Tension: 48.0±5.0 dyne/cm
Molar Volume: 202.0±5.0 cm3

Click to predict properties on the Chemicalize site


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