ChemSpider 2D Image | [5-Amino-2-(hexanoylamino)phenyl]boronic acid | C12H19BN2O3

[5-Amino-2-(hexanoylamino)phenyl]boronic acid

  • Molecular FormulaC12H19BN2O3
  • Average mass250.102 Da
  • Monoisotopic mass250.148880 Da
  • ChemSpider ID62064782

More details:

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

[5-Amino-2-(hexanoylamino)phenyl]boronic acid [ACD/IUPAC Name]
[5-Amino-2-(hexanoylamino)phenyl]borsäure [German] [ACD/IUPAC Name]
220999-51-9 [RN]
Acide [5-amino-2-(hexanoylamino)phényl]boronique [French] [ACD/IUPAC Name]
Boronic acid, [5-amino-2-[(1-oxohexyl)amino]phenyl]-
Boronic acid, B-[5-amino-2-[(1-oxohexyl)amino]phenyl]- [ACD/Index Name]

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

Density: 1.2±0.1 g/cm3
Boiling Point:
Vapour Pressure:
Enthalpy of Vaporization:
Flash Point:
Index of Refraction: 1.555
Molar Refractivity: 68.5±0.4 cm3
#H bond acceptors: 5
#H bond donors: 5
#Freely Rotating Bonds: 6
#Rule of 5 Violations: 1
ACD/LogP: 1.58
ACD/LogD (pH 5.5): 1.61
ACD/BCF (pH 5.5): 9.80
ACD/KOC (pH 5.5): 175.97
ACD/LogD (pH 7.4): 1.56
ACD/BCF (pH 7.4): 8.73
ACD/KOC (pH 7.4): 156.86
Polar Surface Area: 96 Å2
Polarizability: 27.1±0.5 10-24cm3
Surface Tension: 51.6±5.0 dyne/cm
Molar Volume: 213.3±5.0 cm3

Click to predict properties on the Chemicalize site


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