ChemSpider 2D Image | Isopropyl 5-(chlorosulfonyl)-2-methylbenzoate | C11H13ClO4S

Isopropyl 5-(chlorosulfonyl)-2-methylbenzoate

  • Molecular FormulaC11H13ClO4S
  • Average mass276.737 Da
  • Monoisotopic mass276.022308 Da
  • ChemSpider ID58179785

More details:

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

1486804-63-0 [RN]
5-(Chlorosulfonyl)-2-méthylbenzoate d'isopropyle [French] [ACD/IUPAC Name]
Benzoic acid, 5-(chlorosulfonyl)-2-methyl-, 1-methylethyl ester [ACD/Index Name]
Isopropyl 5-(chlorosulfonyl)-2-methylbenzoate [ACD/IUPAC Name]
Isopropyl-5-(chlorsulfonyl)-2-methylbenzoat [German] [ACD/IUPAC Name]
propan-2-yl 5-(chlorosulfonyl)-2-methylbenzoate
MFCD21224845

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

Density: 1.3±0.1 g/cm3
Boiling Point: 366.0±35.0 °C at 760 mmHg
Vapour Pressure: 0.0±0.8 mmHg at 25°C
Enthalpy of Vaporization: 61.2±3.0 kJ/mol
Flash Point: 175.2±25.9 °C
Index of Refraction: 1.524
Molar Refractivity: 65.4±0.4 cm3
#H bond acceptors: 4
#H bond donors: 0
#Freely Rotating Bonds: 4
#Rule of 5 Violations: 0
ACD/LogP: 3.70
ACD/LogD (pH 5.5): 3.40
ACD/BCF (pH 5.5): 225.10
ACD/KOC (pH 5.5): 1680.47
ACD/LogD (pH 7.4): 3.40
ACD/BCF (pH 7.4): 225.10
ACD/KOC (pH 7.4): 1680.47
Polar Surface Area: 69 Å2
Polarizability: 25.9±0.5 10-24cm3
Surface Tension: 41.5±3.0 dyne/cm
Molar Volume: 213.6±3.0 cm3

Click to predict properties on the Chemicalize site


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