Diethyl [2,2'-Bipyridine]-5,5'-dicarboxylate

• CAS: 1762-46-5
• Catalog Number: ACM1762465-2
• Category: Other Products
• Molecular Weight: 300.30
• Molecular Formula: C16H16N2O4
• Synonyms: [2,2'-Bipyridine]-5,5'-dicarboxylic Acid Diethyl Ester
• IUPAC Name: ethyl 6-(5-ethoxycarbonylpyridin-2-yl)pyridine-3-carboxylate
• Canonical SMILES: CCOC(=O)C1=CN=C(C=C1)C2=NC=C(C=C2)C(=O)OCC
• InChI: InChI=1S/C16H16N2O4/c1-3-21-15(19)11-5-7-13(17-9-11)14-8-6-12(10-18-14)16(20)22-4-2/h5-10H,3-4H2,1-2H3
• InChI Key: IUNBUYCOAQHBMC-UHFFFAOYSA-N
• Appearance: Powder or crystal
• Complexity: 352
• Covalently-Bonded Unit Count: 1
• Exact Mass: 300.111g/mol
• H-Bond Acceptor: 6
• Heavy Atom Count: 22
• Monoisotopic Mass: 300.111g/mol
• Rotatable Bond Count: 7
• Topological Polar Surface Area: 78.4A^2