Basic information
- Standard SMILES
BrCc1ccc2ncsc2c1- InChIKey
DQTJVIFWIQJUQI-UHFFFAOYSA-N- Molecular formula
- C8H6BrNS
- Average molar mass
- 228.11 g/mol
Names & identifiers
- Preferred name
- 6-(Bromomethyl)benzo[d]thiazole
- IUPAC
- 6-(bromomethyl)-1,3-benzothiazole
Names & synonyms
6-(Bromomethyl)benzo[d]thiazole499770-85-36-(BROMOMETHYL)-1,3-BENZOTHIAZOLEMFCD056646506-(Bromomethyl)benzothiazoleBenzothiazole, 6-(bromomethyl)-6-bromomethylbenzothiazole6-Bromomethyl-benzothiazoleSCHEMBL506591DQTJVIFWIQJUQI-UHFFFAOYSA-NBS-51639DB-414384
Show more names
6-(BROMOMETHYL)-1,3-BENZO[D]THIAZOLEC753306-(BROMOMETHYL)-1,3-BENZOTHIAZOLE,97%F451854
Database identifiers
- PubChem CID
- 53406993
Properties
Computed structural properties
- XLogP
- 2.6
- Topological polar surface area
- 41.1 Ų
- Hydrogen bond donors
- 0
- Hydrogen bond acceptors
- 2
- Rotatable bonds
- 1
- Heavy atoms
- 11
- Formal charge
- 0
- Complexity
- 142
Related reactions
6 records
Compound notes
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