Found 16 results

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

4-(Isopropylsulfonylphenyl)boronic acid

  • Molecular FormulaC9H13BO4S
  • Average mass228.073 Da
  • Monoisotopic mass228.062759 Da
  • ChemSpider ID21474190

More details:

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

[4-(Isopropylsulfonyl)phenyl]boronic acid [ACD/IUPAC Name]
[4-(Isopropylsulfonyl)phenyl]borsäure [German] [ACD/IUPAC Name]
4-(Isopropylsulfonylphenyl)boronic acid
850567-98-5 [RN]
Acide [4-(isopropylsulfonyl)phényl]boronique [French] [ACD/IUPAC Name]
B-[4-[(1-Methylethyl)sulfonyl]phenyl]boronic acid
Boronic acid, B-[4-[(1-methylethyl)sulfonyl]phenyl]- [ACD/Index Name]
MFCD06659866 [MDL number]
(4-(Isopropylsulfonyl)phenyl)boronic acid
(4-propan-2-ylsulfonylphenyl)boronic acid
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Validated by Experts, Validated by Users, Non-Validated, Removed by Users

CCRIS 4693 [DBID]

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

Density: 1.3±0.1 g/cm3
Boiling Point: 443.1±51.0 °C at 760 mmHg
Vapour Pressure: 0.0±1.1 mmHg at 25°C
Enthalpy of Vaporization: 73.8±3.0 kJ/mol
Flash Point: 221.8±30.4 °C
Index of Refraction: 1.547
Molar Refractivity: 56.0±0.4 cm3
#H bond acceptors: 4
#H bond donors: 2
#Freely Rotating Bonds: 3
#Rule of 5 Violations: 0
ACD/LogP: 0.75
ACD/LogD (pH 5.5): 0.89
ACD/BCF (pH 5.5): 2.80
ACD/KOC (pH 5.5): 72.54
ACD/LogD (pH 7.4): 0.72
ACD/BCF (pH 7.4): 1.90
ACD/KOC (pH 7.4): 49.32
Polar Surface Area: 83 Å2
Polarizability: 22.2±0.5 10-24cm3
Surface Tension: 49.3±5.0 dyne/cm
Molar Volume: 176.6±5.0 cm3

Click to predict properties on the Chemicalize site


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