Structure

2-(Methylcarboxy)pyridine-5-boronic acid pinacol ester

CAS
957065-99-5
Catalog Number
ACM957065995-1
Category
Boronic Esters

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What is the molecular formula of 2-(Methylcarboxy)pyridine-5-boronic acid pinacol ester?

The molecular formula is C13H18BNO4.

What is the molecular weight of 2-(Methylcarboxy)pyridine-5-boronic acid pinacol ester?

The molecular weight is 263.10 g/mol.

What is the IUPAC name of 2-(Methylcarboxy)pyridine-5-boronic acid pinacol ester?

The IUPAC name is methyl 5-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)pyridine-2-carboxylate.

What is the InChI of 2-(Methylcarboxy)pyridine-5-boronic acid pinacol ester?

The InChI is InChI=1S/C13H18BNO4/c1-12(2)13(3,4)19-14(18-12)9-6-7-10(15-8-9)11(16)17-5/h6-8H,1-5H3.

What is the InChIKey of 2-(Methylcarboxy)pyridine-5-boronic acid pinacol ester?

The InChIKey is IXKFGVRURWXXKX-UHFFFAOYSA-N.

What is the canonical SMILES of 2-(Methylcarboxy)pyridine-5-boronic acid pinacol ester?

The canonical SMILES is B1(OC(C(O1)(C)C)(C)C)C2=CN=C(C=C2)C(=O)OC.

What is the CAS number of 2-(Methylcarboxy)pyridine-5-boronic acid pinacol ester?

The CAS number is 957065-99-5.

What is the European Community (EC) number of 2-(Methylcarboxy)pyridine-5-boronic acid pinacol ester?

The EC number is 800-407-0.

What is the DSSTox Substance ID of 2-(Methylcarboxy)pyridine-5-boronic acid pinacol ester?

The DSSTox Substance ID is DTXSID60674322.

Is 2-(Methylcarboxy)pyridine-5-boronic acid pinacol ester canonicalized?

Yes, it is canonicalized.

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