Structure

Pyridine-4-boronic acid

CAS
1692-15-5
Catalog Number
ACM1692155
Category
Boronic Acids
Molecular Weight
122.92
Molecular Formula
C5H6BNO2

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Specification

Synonyms
4-Pyridineboronic
IUPAC Name
pyridin-4-ylboronic acid
Canonical SMILES
B(C1=CC=NC=C1)(O)O
InChI
InChI=1S/C5H6BNO2/c8-6(9)5-1-3-7-4-2-5/h1-4,8-9H
InChI Key
QLULGIRFKAWHOJ-UHFFFAOYSA-N
Density
1.22±0.1 g/ml
Complexity
83
Covalently-Bonded Unit Count
1
Exact Mass
123.049159g/mol
Formal Charge
0
H-Bond Acceptor
3
H-Bond Donor
2
Heavy Atom Count
9
Monoisotopic Mass
123.049159g/mol
Rotatable Bond Count
1
What is the PubChem CID of Pyridine-4-boronic acid?

The PubChem CID of Pyridine-4-boronic acid is 2734379.

What is the molecular formula of Pyridine-4-boronic acid?

The molecular formula of Pyridine-4-boronic acid is C5H6BNO2.

What is the synonym for Pyridine-4-boronic acid?

The synonym for Pyridine-4-boronic acid is Pyridin-4-ylboronic acid.

What is the molecular weight of Pyridine-4-boronic acid?

The molecular weight of Pyridine-4-boronic acid is 122.92 g/mol.

When was Pyridine-4-boronic acid created and last modified?

Pyridine-4-boronic acid was created on July 19, 2005, and last modified on December 2, 2023.

What is the IUPAC name of Pyridine-4-boronic acid?

The IUPAC name of Pyridine-4-boronic acid is pyridin-4-ylboronic acid.

What is the InChI of Pyridine-4-boronic acid?

The InChI of Pyridine-4-boronic acid is "InChI=1S/C5H6BNO2/c8-6(9)5-1-3-7-4-2-5/h1-4,8-9H".

What is the InChIKey of Pyridine-4-boronic acid?

The InChIKey of Pyridine-4-boronic acid is "QLULGIRFKAWHOJ-UHFFFAOYSA-N".

What is the canonical SMILES of Pyridine-4-boronic acid?

The canonical SMILES of Pyridine-4-boronic acid is "B(C1=CC=NC=C1)(O)O".

What is the CAS number and EC number of Pyridine-4-boronic acid?

The CAS number of Pyridine-4-boronic acid is 1692-15-5, and the EC number is 671-679-4.

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