ChemSpider 2D Image | 3-(1-Benzothiophen-3-yl)-6-chloro[1,2,4]triazolo[4,3-b]pyridazine | C13H7ClN4S

3-(1-Benzothiophen-3-yl)-6-chloro[1,2,4]triazolo[4,3-b]pyridazine

  • Molecular FormulaC13H7ClN4S
  • Average mass286.740 Da
  • Monoisotopic mass286.007996 Da
  • ChemSpider ID28550536

More details:

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

1,2,4-Triazolo[4,3-b]pyridazine, 3-benzo[b]thien-3-yl-6-chloro- [ACD/Index Name]
3-(1-Benzothiophen-3-yl)-6-chlor[1,2,4]triazolo[4,3-b]pyridazin [German] [ACD/IUPAC Name]
3-(1-Benzothiophen-3-yl)-6-chloro[1,2,4]triazolo[4,3-b]pyridazine [ACD/IUPAC Name]
3-(1-Benzothiophén-3-yl)-6-chloro[1,2,4]triazolo[4,3-b]pyridazine [French] [ACD/IUPAC Name]
596825-72-8 [RN]

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

Density: 1.6±0.1 g/cm3
Boiling Point:
Vapour Pressure:
Enthalpy of Vaporization:
Flash Point:
Index of Refraction: 1.833
Molar Refractivity: 77.8±0.5 cm3
#H bond acceptors: 4
#H bond donors: 0
#Freely Rotating Bonds: 1
#Rule of 5 Violations: 1
ACD/LogP: 5.13
ACD/LogD (pH 5.5): 3.79
ACD/BCF (pH 5.5): 450.44
ACD/KOC (pH 5.5): 2761.08
ACD/LogD (pH 7.4): 3.79
ACD/BCF (pH 7.4): 450.45
ACD/KOC (pH 7.4): 2761.09
Polar Surface Area: 71 Å2
Polarizability: 30.8±0.5 10-24cm3
Surface Tension: 68.9±7.0 dyne/cm
Molar Volume: 176.6±7.0 cm3

Click to predict properties on the Chemicalize site


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