ChemSpider 2D Image | 1-{[Hydroxy(phenylsulfonyl)boryl]oxy}-1H-indole | C14H12BNO4S

1-{[Hydroxy(phenylsulfonyl)boryl]oxy}-1H-indole

  • Molecular FormulaC14H12BNO4S
  • Average mass301.125 Da
  • Monoisotopic mass301.058014 Da
  • ChemSpider ID24747913

More details:

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

1-{[Hydroxy(phenylsulfonyl)boryl]oxy}-1H-indol [German] [ACD/IUPAC Name]
1-{[Hydroxy(phenylsulfonyl)boryl]oxy}-1H-indole [ACD/IUPAC Name]
1-{[Hydroxy(phénylsulfonyl)boryl]oxy}-1H-indole [French] [ACD/IUPAC Name]
1H-Indole, 1-[[hydroxy(phenylsulfonyl)boryl]oxy]- [ACD/Index Name]
1-(Phenylsulfonyl)-2-indoleboronic acid
1H-INDOL-1-YL HYDROGEN (BENZENESULFONYL)BORONATE
342404-46-0 [RN]
INDOL-1-YL HYDROGEN BENZENESULFONYLBORONATE

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

Density: 1.3±0.1 g/cm3
Boiling Point: 497.5±28.0 °C at 760 mmHg
Vapour Pressure: 0.0±1.3 mmHg at 25°C
Enthalpy of Vaporization: 80.6±3.0 kJ/mol
Flash Point: 254.7±24.0 °C
Index of Refraction: 1.607
Molar Refractivity: 80.2±0.5 cm3
#H bond acceptors: 5
#H bond donors: 1
#Freely Rotating Bonds: 4
#Rule of 5 Violations: 0
ACD/LogP: 4.30
ACD/LogD (pH 5.5): -0.38
ACD/BCF (pH 5.5): 1.00
ACD/KOC (pH 5.5): 1.00
ACD/LogD (pH 7.4): -0.82
ACD/BCF (pH 7.4): 1.00
ACD/KOC (pH 7.4): 1.00
Polar Surface Area: 77 Å2
Polarizability: 31.8±0.5 10-24cm3
Surface Tension: 51.7±7.0 dyne/cm
Molar Volume: 232.3±7.0 cm3

Click to predict properties on the Chemicalize site


Advertisement