CAS
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Specification
The molecular formula is C8H5ClF2O.
It was created on 2005-07-19 and last modified on 2023-12-23.
The IUPAC name is 2,3-difluoro-4-methylbenzoyl chloride.
The InChIKey is IHRMSSGDXMQPBA-UHFFFAOYSA-N.
The Canonical SMILES is CC1=C(C(=C(C=C1)C(=O)Cl)F)F.
The CAS number is 261763-38-6.
The molecular weight is 190.57 g/mol.
It has 3 hydrogen bond acceptor counts.
The topological polar surface area is 17.1 Ų.
Yes, the compound is canonicalized according to PubChem.