ChemSpider 2D Image | 1-[(5-Chloro-4-nitro-2-thienyl)sulfonyl]-3-azetidinamine | C7H8ClN3O4S2

1-[(5-Chloro-4-nitro-2-thienyl)sulfonyl]-3-azetidinamine

  • Molecular FormulaC7H8ClN3O4S2
  • Average mass297.739 Da
  • Monoisotopic mass296.964478 Da
  • ChemSpider ID36373761

More details:

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

1-[(5-Chlor-4-nitro-2-thienyl)sulfonyl]-3-azetidinamin [German] [ACD/IUPAC Name]
1-[(5-Chloro-4-nitro-2-thienyl)sulfonyl]-3-azetidinamine [ACD/IUPAC Name]
1-[(5-Chloro-4-nitro-2-thiényl)sulfonyl]-3-azétidinamine [French] [ACD/IUPAC Name]
3-Azetidinamine, 1-[(5-chloro-4-nitro-2-thienyl)sulfonyl]- [ACD/Index Name]

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

Density: 1.8±0.1 g/cm3
Boiling Point: 492.1±55.0 °C at 760 mmHg
Vapour Pressure: 0.0±1.2 mmHg at 25°C
Enthalpy of Vaporization: 75.9±3.0 kJ/mol
Flash Point: 251.4±31.5 °C
Index of Refraction: 1.675
Molar Refractivity: 63.9±0.4 cm3
#H bond acceptors: 7
#H bond donors: 2
#Freely Rotating Bonds: 3
#Rule of 5 Violations: 0
ACD/LogP: 0.99
ACD/LogD (pH 5.5): 0.41
ACD/BCF (pH 5.5): 1.00
ACD/KOC (pH 5.5): 25.24
ACD/LogD (pH 7.4): 0.83
ACD/BCF (pH 7.4): 2.49
ACD/KOC (pH 7.4): 66.47
Polar Surface Area: 146 Å2
Polarizability: 25.3±0.5 10-24cm3
Surface Tension: 78.9±3.0 dyne/cm
Molar Volume: 170.1±3.0 cm3

Click to predict properties on the Chemicalize site


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