5-Chloro-3-methylbenzo[b]thiophene-2-carbaldehyde
Basic information
- Standard SMILES
Cc1c(C=O)sc2ccc(Cl)cc12- InChIKey
OEHWRIDKBQTMPG-UHFFFAOYSA-N- Molecular formula
- C10H7ClOS
- Average molar mass
- 210.68 g/mol
- Monoisotopic mass
- 209.9906137
Names & identifiers
- Preferred name
- 5-Chloro-3-methylbenzo[b]thiophene-2-carbaldehyde
- IUPAC
- 5-chloro-3-methyl-1-benzothiophene-2-carbaldehyde
Names & synonyms
50451-78-05-chloro-3-methylbenzo[b]thiophene-2-carbaldehyde5-Chloro-3-methyl-benzo[b]thiophene-2-carbaldehyde5-chloro-3-methyl-1-benzothiophene-2-carbaldehydeMFCD018602855-chloro-3-methyl-benzothiophene-2-carbaldehydeSCHEMBL1254005Benzo[b]thiophene-2-carboxaldehyde, 5-chloro-3-methyl-OEHWRIDKBQTMPG-UHFFFAOYSA-NSBB094413AS-5858DB-087251
Show more names
AN-278/25047015F316971
Database identifiers
- PubChem CID
- 3659631
Properties
Computed structural properties
- XLogP
- 3.7
- Topological polar surface area
- 45.3 Ų
- Hydrogen bond donors
- 0
- Hydrogen bond acceptors
- 2
- Rotatable bonds
- 1
- Heavy atoms
- 13
- Formal charge
- 0
- Complexity
- 209
Related reactions
4 records
Compound notes
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