ChemSpider 2D Image | Hexyl ({4-[({4-[(methylsulfonyl)methyl]benzoyl}amino)methyl]phenyl}sulfonyl)carbamate | C23H30N2O7S2

Hexyl ({4-[({4-[(methylsulfonyl)methyl]benzoyl}amino)methyl]phenyl}sulfonyl)carbamate

  • Molecular FormulaC23H30N2O7S2
  • Average mass510.624 Da
  • Monoisotopic mass510.149445 Da
  • ChemSpider ID66099231

More details:

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

({4-[({4-[(Méthylsulfonyl)méthyl]benzoyl}amino)méthyl]phényl}sulfonyl)carbamate d'hexyle [French] [ACD/IUPAC Name]
Carbamic acid, N-[[4-[[[4-[(methylsulfonyl)methyl]benzoyl]amino]methyl]phenyl]sulfonyl]-, hexyl ester [ACD/Index Name]
Hexyl ({4-[({4-[(methylsulfonyl)methyl]benzoyl}amino)methyl]phenyl}sulfonyl)carbamate [ACD/IUPAC Name]
Hexyl-({4-[({4-[(methylsulfonyl)methyl]benzoyl}amino)methyl]phenyl}sulfonyl)carbamat [German] [ACD/IUPAC Name]

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

Density: 1.3±0.1 g/cm3
Boiling Point:
Vapour Pressure:
Enthalpy of Vaporization:
Flash Point:
Index of Refraction: 1.564
Molar Refractivity: 129.3±0.4 cm3
#H bond acceptors: 9
#H bond donors: 2
#Freely Rotating Bonds: 13
#Rule of 5 Violations: 1
ACD/LogP: 2.72
ACD/LogD (pH 5.5): 2.00
ACD/BCF (pH 5.5): 11.97
ACD/KOC (pH 5.5): 115.93
ACD/LogD (pH 7.4): 0.94
ACD/BCF (pH 7.4): 1.06
ACD/KOC (pH 7.4): 10.27
Polar Surface Area: 152 Å2
Polarizability: 51.3±0.5 10-24cm3
Surface Tension: 50.8±3.0 dyne/cm
Molar Volume: 397.4±3.0 cm3

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