ChemSpider 2D Image | N-1,4-Dithiepan-6-ylnorvaline | C10H19NO2S2

N-1,4-Dithiepan-6-ylnorvaline

  • Molecular FormulaC10H19NO2S2
  • Average mass249.393 Da
  • Monoisotopic mass249.085724 Da
  • ChemSpider ID58207849

More details:

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

N-1,4-Dithiepan-6-ylnorvalin [German] [ACD/IUPAC Name]
N-1,4-Dithiepan-6-ylnorvaline [ACD/IUPAC Name]
N-1,4-Dithiépan-6-ylnorvaline [French] [ACD/IUPAC Name]
Norvaline, N-1,4-dithiepan-6-yl- [ACD/Index Name]
2-(1,4-dithiepan-6-ylamino)pentanoic acid

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

Density: 1.2±0.1 g/cm3
Boiling Point: 428.4±45.0 °C at 760 mmHg
Vapour Pressure: 0.0±2.2 mmHg at 25°C
Enthalpy of Vaporization: 75.0±6.0 kJ/mol
Flash Point: 212.9±28.7 °C
Index of Refraction: 1.567
Molar Refractivity: 67.6±0.4 cm3
#H bond acceptors: 3
#H bond donors: 2
#Freely Rotating Bonds: 5
#Rule of 5 Violations: 0
ACD/LogP: 1.96
ACD/LogD (pH 5.5): -0.50
ACD/BCF (pH 5.5): 1.00
ACD/KOC (pH 5.5): 1.00
ACD/LogD (pH 7.4): -0.56
ACD/BCF (pH 7.4): 1.00
ACD/KOC (pH 7.4): 1.00
Polar Surface Area: 100 Å2
Polarizability: 26.8±0.5 10-24cm3
Surface Tension: 50.6±5.0 dyne/cm
Molar Volume: 207.0±5.0 cm3

Click to predict properties on the Chemicalize site


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