Basic information
- CAS
56403-26-0- Standard SMILES
Cc1cc(CCl)c(Br)cc1CCl- InChIKey
AYPOHGOVDHTSDW-UHFFFAOYSA-N- Molecular formula
- C9H9BrCl2
- Average molar mass
- 267.97 g/mol
- Monoisotopic mass
- 265.92647
Names & identifiers
- Preferred name
- 1-Bromo-2,5-bis(chloromethyl)-4-methylbenzene
- IUPAC
- 1-bromo-2,5-bis(chloromethyl)-4-methylbenzene
Names & synonyms
1-bromo-2,5-bis(chloromethyl)-4-methylbenzene56403-26-0DTXSID30310604benzene, 1-bromo-2,5-bis(chloromethyl)-4-methyl-RefChem:228304DTXCID00261730AYPOHGOVDHTSDW-UHFFFAOYSA-NNSC229323SCHEMBL1316061NSC-229323DB-162327
Database identifiers
- CAS
56403-26-0- PubChem CID
- 313683
- DTXSID
DTXSID30310604
Properties
Computed structural properties
- XLogP
- 3.8
- Topological polar surface area
- 0 Ų
- Hydrogen bond donors
- 0
- Hydrogen bond acceptors
- 0
- Rotatable bonds
- 2
- Heavy atoms
- 12
- Formal charge
- 0
- Complexity
- 140
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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