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Search term: MF = 'C_{7}H_{13}F_{2}NO_{2}'

ChemSpider 2D Image | Ethyl 3-amino-4,4-difluoro-3-methylbutanoate | C7H13F2NO2

Ethyl 3-amino-4,4-difluoro-3-methylbutanoate

  • Molecular FormulaC7H13F2NO2
  • Average mass181.180 Da
  • Monoisotopic mass181.091431 Da
  • ChemSpider ID65569881

More details:






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

3-Amino-4,4-difluoro-3-méthylbutanoate d'éthyle [French] [ACD/IUPAC Name]
Butanoic acid, 3-amino-4,4-difluoro-3-methyl-, ethyl ester [ACD/Index Name]
Ethyl 3-amino-4,4-difluoro-3-methylbutanoate [ACD/IUPAC Name]
Ethyl-3-amino-4,4-difluor-3-methylbutanoat [German] [ACD/IUPAC Name]
2161653-52-5 [RN]
MFCD31923979

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

Density: 1.1±0.1 g/cm3
Boiling Point: 218.9±40.0 °C at 760 mmHg
Vapour Pressure: 0.1±0.4 mmHg at 25°C
Enthalpy of Vaporization: 45.5±3.0 kJ/mol
Flash Point: 86.2±27.3 °C
Index of Refraction: 1.407
Molar Refractivity: 40.0±0.3 cm3
#H bond acceptors: 3
#H bond donors: 2
#Freely Rotating Bonds: 5
#Rule of 5 Violations: 0
ACD/LogP: 1.31
ACD/LogD (pH 5.5): -0.40
ACD/BCF (pH 5.5): 1.00
ACD/KOC (pH 5.5): 4.04
ACD/LogD (pH 7.4): 0.74
ACD/BCF (pH 7.4): 2.05
ACD/KOC (pH 7.4): 55.36
Polar Surface Area: 52 Å2
Polarizability: 15.9±0.5 10-24cm3
Surface Tension: 28.6±3.0 dyne/cm
Molar Volume: 162.6±3.0 cm3

Click to predict properties on the Chemicalize site






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