Found 16 results

Search term: MF = 'C_{9}H_{13}BO_{4}S'
ChemSpider 2D Image | [3-(Propylsulfonyl)phenyl]boronic acid | C9H13BO4S

[3-(Propylsulfonyl)phenyl]boronic acid

  • Molecular FormulaC9H13BO4S
  • Average mass228.073 Da
  • Monoisotopic mass228.062759 Da
  • ChemSpider ID60794297

More details:

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

[3-(Propylsulfonyl)phenyl]boronic acid [ACD/IUPAC Name]
[3-(Propylsulfonyl)phenyl]borsäure [German] [ACD/IUPAC Name]
Acide [3-(propylsulfonyl)phényl]boronique [French] [ACD/IUPAC Name]
Boronic acid, B-[3-(propylsulfonyl)phenyl]- [ACD/Index Name]
[3-(PROPANE-1-SULFONYL)PHENYL]BORONIC ACID
1313617-52-5 [RN]
3-(PROPANE-1-SULFONYL)PHENYLBORONIC ACID
3-(PRopylsulfonyl)phenylboronic acid
MFCD22199583

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

Density: 1.3±0.1 g/cm3
Boiling Point: 478.2±51.0 °C at 760 mmHg
Vapour Pressure: 0.0±1.3 mmHg at 25°C
Enthalpy of Vaporization: 78.2±3.0 kJ/mol
Flash Point: 243.0±30.4 °C
Index of Refraction: 1.549
Molar Refractivity: 56.0±0.4 cm3
#H bond acceptors: 4
#H bond donors: 2
#Freely Rotating Bonds: 4
#Rule of 5 Violations: 0
ACD/LogP: 0.93
ACD/LogD (pH 5.5): 0.94
ACD/BCF (pH 5.5): 3.05
ACD/KOC (pH 5.5): 76.90
ACD/LogD (pH 7.4): 0.54
ACD/BCF (pH 7.4): 1.20
ACD/KOC (pH 7.4): 30.28
Polar Surface Area: 83 Å2
Polarizability: 22.2±0.5 10-24cm3
Surface Tension: 50.8±5.0 dyne/cm
Molar Volume: 176.0±5.0 cm3

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