Found 50 results

Search term: MF = 'C_{7}H_{9}NO_{6}S'
ChemSpider 2D Image | 2,3,4-Trihydroxybenzyl sulfamate | C7H9NO6S

2,3,4-Trihydroxybenzyl sulfamate

  • Molecular FormulaC7H9NO6S
  • Average mass235.214 Da
  • Monoisotopic mass235.015060 Da
  • ChemSpider ID65485215

More details:

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

2,3,4-Trihydroxybenzyl sulfamate [ACD/IUPAC Name]
2,3,4-Trihydroxybenzylsulfamat [German] [ACD/IUPAC Name]
Sulfamate de 2,3,4-trihydroxybenzyle [French] [ACD/IUPAC Name]
Sulfamic acid, (2,3,4-trihydroxyphenyl)methyl ester [ACD/Index Name]
(2,3,4-trihydroxyphenyl)methyl sulfamate
2228990-89-2 [RN]

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

Density: 1.8±0.1 g/cm3
Boiling Point: 545.0±60.0 °C at 760 mmHg
Vapour Pressure: 0.0±1.5 mmHg at 25°C
Enthalpy of Vaporization: 85.5±3.0 kJ/mol
Flash Point: 283.4±32.9 °C
Index of Refraction: 1.684
Molar Refractivity: 50.2±0.4 cm3
#H bond acceptors: 7
#H bond donors: 5
#Freely Rotating Bonds: 3
#Rule of 5 Violations: 1
ACD/LogP: -0.98
ACD/LogD (pH 5.5): -0.78
ACD/BCF (pH 5.5): 1.00
ACD/KOC (pH 5.5): 9.01
ACD/LogD (pH 7.4): -0.82
ACD/BCF (pH 7.4): 1.00
ACD/KOC (pH 7.4): 8.15
Polar Surface Area: 138 Å2
Polarizability: 19.9±0.5 10-24cm3
Surface Tension: 103.2±3.0 dyne/cm
Molar Volume: 132.1±3.0 cm3

Click to predict properties on the Chemicalize site


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