ChemSpider 2D Image | 3-[(2,6-Diisopropylphenyl)acetyl]-2,4,6-triisopropylphenyl sulfamate | C29H43NO4S

3-[(2,6-Diisopropylphenyl)acetyl]-2,4,6-triisopropylphenyl sulfamate

  • Molecular FormulaC29H43NO4S
  • Average mass501.721 Da
  • Monoisotopic mass501.291290 Da
  • ChemSpider ID8339553

More details:

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

3-[(2,6-Diisopropylphenyl)acetyl]-2,4,6-triisopropylphenyl sulfamate [ACD/IUPAC Name]
3-[(2,6-Diisopropylphenyl)acetyl]-2,4,6-triisopropylphenylsulfamat [German] [ACD/IUPAC Name]
Sulfamate de 3-[2-(2,6-diisopropylphényl)acétyl]-2,4,6-triisopropylphényle [French] [ACD/IUPAC Name]
Sulfamic acid, 3-[2-[2,6-bis(1-methylethyl)phenyl]acetyl]-2,4,6-tris(1-methylethyl)phenyl ester [ACD/Index Name]

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

Density: 1.1±0.1 g/cm3
Boiling Point: 600.8±65.0 °C at 760 mmHg
Vapour Pressure: 0.0±1.7 mmHg at 25°C
Enthalpy of Vaporization: 89.4±3.0 kJ/mol
Flash Point: 317.1±34.3 °C
Index of Refraction: 1.534
Molar Refractivity: 144.3±0.4 cm3
#H bond acceptors: 5
#H bond donors: 2
#Freely Rotating Bonds: 10
#Rule of 5 Violations: 2
ACD/LogP: 8.82
ACD/LogD (pH 5.5): 7.31
ACD/BCF (pH 5.5): 210954.69
ACD/KOC (pH 5.5): 225143.02
ACD/LogD (pH 7.4): 7.26
ACD/BCF (pH 7.4): 190216.94
ACD/KOC (pH 7.4): 203010.48
Polar Surface Area: 95 Å2
Polarizability: 57.2±0.5 10-24cm3
Surface Tension: 40.2±3.0 dyne/cm
Molar Volume: 464.2±3.0 cm3

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