ChemSpider 2D Image | 4-[(Chloromethyl)sulfonyl]-1,4-diazepan-2-one | C6H11ClN2O3S

4-[(Chloromethyl)sulfonyl]-1,4-diazepan-2-one

  • Molecular FormulaC6H11ClN2O3S
  • Average mass226.681 Da
  • Monoisotopic mass226.017883 Da
  • ChemSpider ID48723881

More details:

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

2H-1,4-Diazepin-2-one, 4-[(chloromethyl)sulfonyl]hexahydro- [ACD/Index Name]
4-[(Chlormethyl)sulfonyl]-1,4-diazepan-2-on [German] [ACD/IUPAC Name]
4-[(Chloromethyl)sulfonyl]-1,4-diazepan-2-one [ACD/IUPAC Name]
4-[(Chlorométhyl)sulfonyl]-1,4-diazépan-2-one [French] [ACD/IUPAC Name]
1485369-55-8 [RN]
MFCD21195181

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

Density: 1.5±0.1 g/cm3
Boiling Point:
Vapour Pressure:
Enthalpy of Vaporization:
Flash Point:
Index of Refraction: 1.557
Molar Refractivity: 49.1±0.4 cm3
#H bond acceptors: 5
#H bond donors: 1
#Freely Rotating Bonds: 2
#Rule of 5 Violations: 0
ACD/LogP: -1.59
ACD/LogD (pH 5.5): -0.88
ACD/BCF (pH 5.5): 1.00
ACD/KOC (pH 5.5): 7.86
ACD/LogD (pH 7.4): -0.88
ACD/BCF (pH 7.4): 1.00
ACD/KOC (pH 7.4): 7.86
Polar Surface Area: 75 Å2
Polarizability: 19.5±0.5 10-24cm3
Surface Tension: 57.1±5.0 dyne/cm
Molar Volume: 152.4±5.0 cm3

Click to predict properties on the Chemicalize site


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