ChemSpider 2D Image | 3-(Isobutyramido)benzeneboronic acid | C10H14BNO3

3-(Isobutyramido)benzeneboronic acid

  • Molecular FormulaC10H14BNO3
  • Average mass207.034 Da
  • Monoisotopic mass207.106674 Da
  • ChemSpider ID21474331

More details:

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

[3-(Isobutyrylamino)phenyl]boronic acid [ACD/IUPAC Name]
[3-(Isobutyrylamino)phenyl]borsäure [German] [ACD/IUPAC Name]
3-(isobutanoylamino)benzeneboronic acid
3-(Isobutyramido)benzeneboronic acid
874459-76-4 [RN]
Acide [3-(isobutyrylamino)phényl]boronique [French] [ACD/IUPAC Name]
B-[3-[(2-Methyl-1-oxopropyl)amino]phenyl]boronic acid
Boronic acid, B-[3-[(2-methyl-1-oxopropyl)amino]phenyl]- [ACD/Index Name]
MFCD08235080 [MDL number]
(2R)-2-(9H-fluoren-9-ylmethoxycarbonylamino)-4-methyl-pentanoic acid;Fmoc-D-Leu-OH
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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: 1.536
Molar Refractivity: 55.5±0.4 cm3
#H bond acceptors: 4
#H bond donors: 3
#Freely Rotating Bonds: 3
#Rule of 5 Violations: 0
ACD/LogP: 1.33
ACD/LogD (pH 5.5): 1.34
ACD/BCF (pH 5.5): 6.13
ACD/KOC (pH 5.5): 127.28
ACD/LogD (pH 7.4): 1.25
ACD/BCF (pH 7.4): 5.00
ACD/KOC (pH 7.4): 103.93
Polar Surface Area: 70 Å2
Polarizability: 22.0±0.5 10-24cm3
Surface Tension: 45.2±5.0 dyne/cm
Molar Volume: 178.0±5.0 cm3

Click to predict properties on the Chemicalize site


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