ChemSpider 2D Image | 4-(3,4-Dihydro-2-naphthalenylsulfonyl)-1,4-thiazepane | C15H19NO2S2

4-(3,4-Dihydro-2-naphthalenylsulfonyl)-1,4-thiazepane

  • Molecular FormulaC15H19NO2S2
  • Average mass309.447 Da
  • Monoisotopic mass309.085724 Da
  • ChemSpider ID30030533

More details:

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

1,4-Thiazepine, 4-[(3,4-dihydro-2-naphthalenyl)sulfonyl]hexahydro- [ACD/Index Name]
4-(3,4-Dihydro-2-naphtalénylsulfonyl)-1,4-thiazépane [French] [ACD/IUPAC Name]
4-(3,4-Dihydro-2-naphthalenylsulfonyl)-1,4-thiazepane [ACD/IUPAC Name]
4-(3,4-Dihydro-2-naphthalinylsulfonyl)-1,4-thiazepan [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: 486.8±55.0 °C at 760 mmHg
Vapour Pressure: 0.0±1.2 mmHg at 25°C
Enthalpy of Vaporization: 75.3±3.0 kJ/mol
Flash Point: 248.2±31.5 °C
Index of Refraction: 1.648
Molar Refractivity: 84.7±0.4 cm3
#H bond acceptors: 3
#H bond donors: 0
#Freely Rotating Bonds: 2
#Rule of 5 Violations: 0
ACD/LogP: 3.15
ACD/LogD (pH 5.5): 3.61
ACD/BCF (pH 5.5): 323.82
ACD/KOC (pH 5.5): 2180.11
ACD/LogD (pH 7.4): 3.61
ACD/BCF (pH 7.4): 323.82
ACD/KOC (pH 7.4): 2180.11
Polar Surface Area: 71 Å2
Polarizability: 33.6±0.5 10-24cm3
Surface Tension: 59.1±5.0 dyne/cm
Molar Volume: 233.0±5.0 cm3

Click to predict properties on the Chemicalize site


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