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3-Chloro-benzo[b]thiophene-2-carboxylic acid

Catalog Number ACM21211223-1
CAS Number 21211-22-3
Structure
Synonyms 3-Chloro-1-benzothiophene-2-carboxylic acid
IUPAC Name 3-chloro-1-benzothiophene-2-carboxylic acid
Molecular Weight 212.65
Molecular Formula C9H5ClO2S
Canonical SMILES C1=CC=C2C(=C1)C(=C(S2)C(=O)O)Cl
InChI InChI=1S/C9H5ClO2S/c10-7-5-3-1-2-4-6(5)13-8(7)9(11)12/h1-4H,(H,11,12)
InChI Key HJTMIYKPPPYDRJ-UHFFFAOYSA-N
Boiling Point 395.1±22.0 ºC
Melting Point 268-272 ºC (lit.)
Purity 98%+
Density 1.546±0.06 g/ml