CAS
409108-13-0 Purity
98%
409108-13-0 Purity
98%
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Specification
PubChem CID 3249312.
The molecular formula is C9H11BO4.
The molecular weight is 193.99 g/mol.
The IUPAC name is (3-ethoxycarbonylphenyl)boronic acid.
The InChI is InChI=1S/C9H11BO4/c1-2-14-9(11)7-4-3-5-8(6-7)10(12)13/h3-6,12-13H,2H2,1H3.
The InChIKey is REHVCPNQQBDOJJ-UHFFFAOYSA-N.
The canonical SMILES is B(C1=CC(=CC=C1)C(=O)OCC)(O)O.
The CAS number is 4334-87-6.
The ChEMBL ID is CHEMBL488800.
Yes, 3-Ethoxycarbonylphenylboronic acid has a covalently-bonded unit count of 1.