ChemSpider 2D Image | [({[3-Chloro-4-(1H-tetrazol-5-yl)phenyl]sulfonyl}amino)methyl]boronic acid | C8H9BClN5O4S

[({[3-Chloro-4-(1H-tetrazol-5-yl)phenyl]sulfonyl}amino)methyl]boronic acid

  • Molecular FormulaC8H9BClN5O4S
  • Average mass317.517 Da
  • Monoisotopic mass317.015686 Da
  • ChemSpider ID35033411

More details:

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

[({[3-Chlor-4-(1H-tetrazol-5-yl)phenyl]sulfonyl}amino)methyl]borsäure [German] [ACD/IUPAC Name]
[({[3-Chloro-4-(1H-tetrazol-5-yl)phenyl]sulfonyl}amino)methyl]boronic acid [ACD/IUPAC Name]
Acide [({[3-chloro-4-(1H-tétrazol-5-yl)phényl]sulfonyl}amino)méthyl]boronique [French] [ACD/IUPAC Name]
Boronic acid, B-[[[[3-chloro-4-(1H-tetrazol-5-yl)phenyl]sulfonyl]amino]methyl]- [ACD/Index Name]
0NB

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

Density: 1.7±0.1 g/cm3
Boiling Point: 643.4±65.0 °C at 760 mmHg
Vapour Pressure: 0.0±2.0 mmHg at 25°C
Enthalpy of Vaporization: 99.8±3.0 kJ/mol
Flash Point: 342.9±34.3 °C
Index of Refraction: 1.617
Molar Refractivity: 67.2±0.4 cm3
#H bond acceptors: 9
#H bond donors: 4
#Freely Rotating Bonds: 5
#Rule of 5 Violations: 0
ACD/LogP: 1.15
ACD/LogD (pH 5.5): -0.99
ACD/BCF (pH 5.5): 1.00
ACD/KOC (pH 5.5): 1.14
ACD/LogD (pH 7.4): -1.46
ACD/BCF (pH 7.4): 1.00
ACD/KOC (pH 7.4): 1.00
Polar Surface Area: 149 Å2
Polarizability: 26.7±0.5 10-24cm3
Surface Tension: 81.2±3.0 dyne/cm
Molar Volume: 192.2±3.0 cm3

Click to predict properties on the Chemicalize site


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