Basic information
- Standard SMILES
Cc1ccc(Sc2ccc(Br)cc2Br)c(C)c1- InChIKey
OKJUYOGLUIBGSI-UHFFFAOYSA-N- Molecular formula
- C14H12Br2S
- Average molar mass
- 372.1 g/mol
Names & identifiers
- Preferred name
- 1,5-Dibromo-2-(2,4-dimethyl-phenylsulfanyl)-benzene
- IUPAC
- 2,4-dibromo-1-(2,4-dimethylphenyl)sulfanylbenzene
Names & synonyms
SCHEMBL3546034OKJUYOGLUIBGSI-UHFFFAOYSA-N1,5-Dibromo-2-(2,4-dimethyl-phenylsulfanyl)-benzene
Database identifiers
- PubChem CID
- 68684693
Properties
Computed structural properties
- XLogP
- 6.1
- Topological polar surface area
- 25.3 Ų
- Hydrogen bond donors
- 0
- Hydrogen bond acceptors
- 1
- Rotatable bonds
- 2
- Heavy atoms
- 17
- Formal charge
- 0
- Complexity
- 246
Related reactions
2 records
Compound notes
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