CAS
91934-77-9 Purity
96%
91934-77-9 Purity
96%
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The molecular formula is C7H5BCl2O3.
It was created on 2007-06-18 and last modified on 2023-12-30.
The IUPAC name is (2,5-dichloro-3-formylphenyl)boronic acid.
The Canonical SMILES is B(C1=CC(=CC(=C1Cl)C=O)Cl)(O)O.
The InChIKey is ZMTZUARCIXQUEI-UHFFFAOYSA-N.
The molecular weight is 218.83 g/mol.
The compound has 2 hydrogen bond donor counts.
The topological polar surface area is 57.5 Ų.
No, the compound has 0 defined atom stereocenter count.
Yes, the compound is canonicalized.