Found 68 results

Search term: MF = 'C_{13}H_{21}BFNO_{2}'
ChemSpider 2D Image | (3-Fluoro-4-{[methyl(3-methyl-2-butanyl)amino]methyl}phenyl)boronic acid | C13H21BFNO2

(3-Fluoro-4-{[methyl(3-methyl-2-butanyl)amino]methyl}phenyl)boronic acid

  • Molecular FormulaC13H21BFNO2
  • Average mass253.121 Da
  • Monoisotopic mass253.164932 Da
  • ChemSpider ID33952369

More details:

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

(3-Fluor-4-{[methyl(3-methyl-2-butanyl)amino]methyl}phenyl)borsäure [German] [ACD/IUPAC Name]
(3-Fluoro-4-{[methyl(3-methyl-2-butanyl)amino]methyl}phenyl)boronic acid [ACD/IUPAC Name]
Acide (3-fluoro-4-{[méthyl(3-méthyl-2-butanyl)amino]méthyl}phényl)boronique [French] [ACD/IUPAC Name]
Boronic acid, B-[4-[[(1,2-dimethylpropyl)methylamino]methyl]-3-fluorophenyl]- [ACD/Index Name]

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

Density: 1.1±0.1 g/cm3
Boiling Point: 347.7±52.0 °C at 760 mmHg
Vapour Pressure: 0.0±0.8 mmHg at 25°C
Enthalpy of Vaporization: 62.5±3.0 kJ/mol
Flash Point: 164.1±30.7 °C
Index of Refraction: 1.507
Molar Refractivity: 69.6±0.4 cm3
#H bond acceptors: 3
#H bond donors: 2
#Freely Rotating Bonds: 5
#Rule of 5 Violations: 0
ACD/LogP: 3.16
ACD/LogD (pH 5.5): 0.15
ACD/BCF (pH 5.5): 1.00
ACD/KOC (pH 5.5): 1.90
ACD/LogD (pH 7.4): 1.56
ACD/BCF (pH 7.4): 4.75
ACD/KOC (pH 7.4): 49.42
Polar Surface Area: 44 Å2
Polarizability: 27.6±0.5 10-24cm3
Surface Tension: 37.7±5.0 dyne/cm
Molar Volume: 234.1±5.0 cm3

Click to predict properties on the Chemicalize site


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