3-Chloro-5-(trifluoromethyl)-pyridazine

• Catalog Number: ACM845617994
• Product Name: 3-Chloro-5-(trifluoromethyl)-pyridazine
• CAS: 845617-99-4
• Category: Pyridines
• Synonyms: 3-Chloro-5-trifluoromethyl-pyridazine
• IUPAC Name: 3-Chloro-5-(trifluoroMethyl)pyridazine
• Molecular Weight: 182.53
• Molecular Formula: C5H2ClF3N2
• Canonical SMILES: C1=C(C=NN=C1Cl)C(F)(F)F
• InChI: InChI=1S/C5H2ClF3N2/c6-4-1-3(2-10-11-4)5(7,8)9/h1-2H
• InChI Key: GEFXHRCGAYIERB-UHFFFAOYSA-N
• Boiling Point: 218.2±35.0 °C
• Density: 1.504±0.06 g/cm3
• Storage: 2-8 °C
• Complexity: 138
• Covalently-Bonded Unit Count: 1
• Defined Atom Stereocenter Count: 0
• Exact Mass: 181.9858603
• Heavy Atom Count: 11
• Monoisotopic Mass: 181.9858603
• Physical State: Solid
• Topological Polar Surface Area: 25.8 Ų