6-Chloro-4-methyl-1-benzothiophen-3-ol
Basic information
- CAS
5340-96-5- Standard SMILES
Cc1cc(Cl)cc2scc(O)c12- InChIKey
DKYFBPUTEGRWLF-UHFFFAOYSA-N- Molecular formula
- C9H7ClOS
- Average molar mass
- 198.67 g/mol
- Monoisotopic mass
- 197.9906137
Names & identifiers
- Preferred name
- 6-Chloro-4-methyl-1-benzothiophen-3-ol
- IUPAC
- 6-chloro-4-methyl-1-benzothiophen-3-ol
- English name
- 6-bromo-4-methylbenzo[b]thiophen-3(2H)-one
- Molecular formula
- C9H7ClOS
- Molecular weight
- 198.67
Names & synonyms
6-chloro-4-methyl-1-benzothiophen-3-ol5340-96-5DTXSID00277376RefChem:307978DTXCID902285346-Chloro-4-methylbenzo[b]thiophen-3-olNSC2029SCHEMBL7775873NSC-2029AKOS0063462773-Hydroxy-4-methyl-6-chloro-thionaphthene6-Chloro-4-methyl-1-benzothiophene-3-ol
Show more names
6-chloro-4-methyl-benzothiophen-3-olBenzo[b]thiophene-3-ol, 6-chloro-4-methyl-6-bromo-4-methylbenzo[b]thiophen-3(2H)-one4-Methyl-6-chloro-3-hydroxybenzo[b]thiophene
Database identifiers
- CAS
5340-96-5- PubChem CID
- 219995
- DTXSID
DTXSID00277376- Nikkaji
- J26.074F
Properties
Computed structural properties
- XLogP
- 3.6
- Topological polar surface area
- 48.5 Ų
- Hydrogen bond donors
- 1
- Hydrogen bond acceptors
- 2
- Rotatable bonds
- 0
- Heavy atoms
- 12
- Formal charge
- 0
- Complexity
- 176
Chemistry & industry
Upstream & downstream products
Downstream products
Related reactions
0 records
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Compound notes
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