Structure

2-Bromopyridine-5-boronic acid

CAS
223463-14-7
Catalog Number
ACM223463147
Category
Boronic Acids
Molecular Weight
201.82g/mol
Molecular Formula
C5H5BBrNO2

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Specification

IUPAC Name
(6-bromopyridin-3-yl)boronic acid
SMILES
B(C1=CN=C(C=C1)Br)(O)O
InChI
InChI=1S/C5H5BBrNO2/c7-5-2-1-4(3-8-5)6(9)10/h1-3,9-10H
InChI Key
BCYWDUVHAPHGIP-UHFFFAOYSA-N
Complexity
114
Covalently-Bonded Unit Count
1
Exact Mass
200.95967g/mol
Formal Charge
0
H-Bond Acceptor
3
H-Bond Donor
2
Heavy Atom Count
10
Monoisotopic Mass
200.95967g/mol
Rotatable Bond Count
1
What is the PubChem CID of 2-Bromopyridine-5-boronic acid?

PubChem CID 2762706.

What is the molecular formula of 2-Bromopyridine-5-boronic acid?

The molecular formula is C5H5BBrNO2.

What is the molecular weight of 2-Bromopyridine-5-boronic acid?

The molecular weight is 201.82 g/mol.

What is the IUPAC name of 2-Bromopyridine-5-boronic acid?

The IUPAC name is (6-bromopyridin-3-yl)boronic acid.

What is the InChI of 2-Bromopyridine-5-boronic acid?

The InChI is InChI=1S/C5H5BBrNO2/c7-5-2-1-4(3-8-5)6(9)10/h1-3,9-10H.

What is the InChIKey of 2-Bromopyridine-5-boronic acid?

The InChIKey is BCYWDUVHAPHGIP-UHFFFAOYSA-N.

What is the canonical SMILES of 2-Bromopyridine-5-boronic acid?

The canonical SMILES is B(C1=CN=C(C=C1)Br)(O)O.

What is the CAS number of 2-Bromopyridine-5-boronic acid?

The CAS number is 223463-14-7.

What is the European Community (EC) number of 2-Bromopyridine-5-boronic acid?

The EC number is 672-028-7.

What is the ChEMBL ID of 2-Bromopyridine-5-boronic acid?

The ChEMBL ID is CHEMBL3236616.

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