CAS
920008-01-1 Purity
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920008-01-1 Purity
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The molecular formula is C9H5ClFNO2.
The molecular weight is 213.59 g/mol.
The IUPAC name is 6-chloro-5-fluoro-1H-indole-3-carboxylic acid.
The InChI is InChI=1S/C9H5ClFNO2/c10-6-2-8-4(1-7(6)11)5(3-12-8)9(13)14/h1-3,12H,(H,13,14).
The InChIKey is BYZWQWXXUXTWSQ-UHFFFAOYSA-N.
The canonical SMILES is C1=C2C(=CC(=C1F)Cl)NC=C2C(=O)O.
The CAS number is 920023-30-9.
It has 2 hydrogen bond donor counts.
It has 3 hydrogen bond acceptor counts.