4-[(2-Ethylquinolin-4-yloxy)methyl]phenylboronic acid hydrochloride

HCID 67782827CAS 144095-45-4
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Basic information

Standard SMILES
CCc1cc(OCc2ccc(B(O)O)cc2)c2ccccc2n1.Cl
InChIKey
VMZDIBSRABTXNN-UHFFFAOYSA-N
Molecular formula
C18H19BClNO3
Average molar mass
343.6 g/mol

Names & identifiers

Preferred name
4-[(2-Ethylquinolin-4-yloxy)methyl]phenylboronic acid hydrochloride
IUPAC
[4-[(2-ethylquinolin-4-yl)oxymethyl]phenyl]boronic acid;hydrochloride

Names & synonyms

SCHEMBL9137327VMZDIBSRABTXNN-UHFFFAOYSA-N4-[(2-ethylquinolin-4-yloxy)methyl]phenylboronic acid hydrochloride144095-45-4

Database identifiers

CAS
144095-45-4
PubChem CID
67782827

Properties

Computed structural properties

Topological polar surface area
62.6 Ų
Hydrogen bond donors
3
Hydrogen bond acceptors
4
Rotatable bonds
5
Heavy atoms
24

Related reactions

7 records
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Linked notes

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