2-Chloro-1-(6-Chloro-3-Pyridinyl)Ethanone
[CAS# 136592-00-2]

Identification

• Name: 2-Chloro-1-(6-Chloro-3-Pyridinyl)Ethanone
• Synonyms: 2-chloro-1-(6-chloropyridin-3-yl)ethanone; Ethanone,2-chloro-1-(6-chloro-3-pyridinyl)-
• Molecular Formula: C₇H₅Cl₂NO
• Molecular Weight: 190.03
• CAS Registry Number: 136592-00-2
• SMILES: O=C(c1cnc(Cl)cc1)CCl
• InChI: 1S/C7H5Cl2NO/c8-3-6(11)5-1-2-7(9)10-4-5/h1-2,4H,3H2
• InChIKey: PALWQAXUGVUEIR-UHFFFAOYSA-N

Properties

• Density: 1.382g/cm³ (Cal.)
• Boiling point: 328.802°C at 760 mmHg (Cal.)
• Flash point: 152.654°C (Cal.)
• Refractive index: 1.555 (Cal.)

References

• (1): Matthew Badland, Michael P. Burns, Robert J. Carroll, Roger M. Howard, Daniel Laity and Nathan J. Wymer. Application of biocatalysis towards asymmetric reduction and hydrolytic desymmetrisation in the synthesis of a β-3 receptor agonist, Green Chem., 2011, 13, 2888.