1-benzothiophene-3-carboxylic acid

Name: 1-benzothiophene-3-carboxylic acid
SKU: ACM5381259
Rating: 5 (1 reviews)

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Catalog NumberACM5381259

CAS Number5381-25-9

CategorySmall Molecule Semiconductor Building Blocks

IUPAC Name

1-benzothiophene-3-carboxylic acid

Molecular Weight

178.21g/mol

Molecular Formula

C9H6O2S

Canonical SMILES

C1=CC=C2C(=C1)C(=CS2)C(=O)O

InChI

InChI=1S/C9H6O2S/c10-9(11)7-5-12-8-4-2-1-3-6(7)8/h1-5H,(H,10,11)

InChI Key

DRBLTQNCQJXSNU-UHFFFAOYSA-N

Purity

98%

Complexity

193

Covalently-Bonded Unit Count

Exact Mass

178.008851g/mol

Formal Charge

Heavy Atom Count

Monoisotopic Mass

178.008851g/mol

Rotatable Bond Count

XLogP3

2.6

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