CAS
408506-61-6 Purity
97%
408506-61-6 Purity
97%
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Specification
The molecular formula is C9H7ClO3.
The molecular weight is 198.60 g/mol.
The IUPAC name is 7-chloro-2,3-dihydro-1-benzofuran-2-carboxylic acid.
The InChIKey is KSSRTMJGUNWSTN-UHFFFAOYSA-N.
It has 1 hydrogen bond donor count.
The topological polar surface area is 46.5 Ų.
Yes, the compound is canonicalized.
It was created on 2013-07-24 and last modified on 2023-12-30.
The Canonical SMILES is C1C(OC2=C1C=CC=C2Cl)C(=O)O.
The CAS number is 26018-45-1.