2-Methyl-5-nitro-pyridine-boronic acid pinacol ester

• Catalog Number: ACM1008138666
• Product Name: 2-Methyl-5-nitro-pyridine-boronic acid pinacol ester
• CAS: 1008138-66-6
• Category: Boric Acids
• Synonyms: 2-Methyl-5-nitro-3-(tetramethyl-1,3,2-dioxaborolan-2-yl)pyridine
• IUPAC Name: 2-Methyl-5-nitro-3-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)pyridine
• Molecular Weight: 264.09
• Molecular Formula: C12H17BN2O4
• Canonical SMILES: B1(OC(C(O1)(C)C)(C)C)C2=CC(=CN=C2C)[N+](=O)[O-]
• InChI: InChI=1S/C12H17BN2O4/c1-8-10(6-9(7-14-8)15(16)17)13-18-11(2,3)12(4,5)19-13/h6-7H,1-5H3
• InChI Key: IYYWRANRHLVQPQ-UHFFFAOYSA-N
• Complexity: 353
• Covalently-Bonded Unit Count: 1
• Defined Atom Stereocenter Count: 0
• Exact Mass: 264.1281372
• Heavy Atom Count: 19
• Monoisotopic Mass: 264.1281372
• Physical State: Solid
• Topological Polar Surface Area: 77.2 Ų