Pyrido[2,3-b]pyrazin-7-ylboronic acid pinacol ester

• CAS: 1210047-44-1
• Catalog Number: ACM1210047441-1
• Category: Other
• Molecular Weight: 257.1g/mol
• Molecular Formula: C13H16BN3O2
• IUPAC Name: 7-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)pyrido[2,3-b]pyrazine
• Canonical SMILES: B1(OC(C(O1)(C)C)(C)C)C2=CC3=NC=CN=C3N=C2
• InChI: InChI=1S/C13H16BN3O2/c1-12(2)13(3,4)19-14(18-12)9-7-10-11(17-8-9)16-6-5-15-10/h5-8H,1-4H3
• InChI Key: QLYMAIYXJXENHJ-UHFFFAOYSA-N
• Complexity: 335
• Covalently-Bonded Unit Count: 1
• Exact Mass: 257.133557g/mol
• Formal Charge: 0
• H-Bond Acceptor: 5
• H-Bond Donor: 0
• Heavy Atom Count: 19
• Monoisotopic Mass: 257.133557g/mol
• Rotatable Bond Count: 1

Custom Q&A

What is the molecular formula of Pyrido[2,3-b]pyrazin-7-ylboronic acid pinacol ester?

The molecular formula is C13H16BN3O2.

What is the molecular weight of Pyrido[2,3-b]pyrazin-7-ylboronic acid pinacol ester?

The molecular weight is 257.10 g/mol.

What is the IUPAC name of Pyrido[2,3-b]pyrazin-7-ylboronic acid pinacol ester?

The IUPAC name is 7-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)pyrido[2,3-b]pyrazine.

What is the CAS number of Pyrido[2,3-b]pyrazin-7-ylboronic acid pinacol ester?

The CAS number is 1210047-44-1.

What is the InChI key of Pyrido[2,3-b]pyrazin-7-ylboronic acid pinacol ester?

The InChI key is QLYMAIYXJXENHJ-UHFFFAOYSA-N.

What is the hydrogen bond donor count of Pyrido[2,3-b]pyrazin-7-ylboronic acid pinacol ester?

The hydrogen bond donor count is 0.

What is the hydrogen bond acceptor count of Pyrido[2,3-b]pyrazin-7-ylboronic acid pinacol ester?

The hydrogen bond acceptor count is 5.

What is the rotatable bond count of Pyrido[2,3-b]pyrazin-7-ylboronic acid pinacol ester?

The rotatable bond count is 1.

What is the topological polar surface area of Pyrido[2,3-b]pyrazin-7-ylboronic acid pinacol ester?

The topological polar surface area is 57.1Ų.

Is Pyrido[2,3-b]pyrazin-7-ylboronic acid pinacol ester a canonical compound?

Yes, Pyrido[2,3-b]pyrazin-7-ylboronic acid pinacol ester is canonicalized.