Basic information
- CAS
56474-57-8- Standard SMILES
COc1c(C)c(C)c(Br)c(C)c1C- InChIKey
CALWRWLFQOSHNJ-UHFFFAOYSA-N- Molecular formula
- C11H15BrO
- Average molar mass
- 243.14 g/mol
- Monoisotopic mass
- 242.03063
Names & identifiers
- Preferred name
- 1-Bromo-4-methoxy-2,3,5,6-tetramethylbenzene
- IUPAC
- 1-bromo-4-methoxy-2,3,5,6-tetramethylbenzene
Names & synonyms
56474-57-81-bromo-4-methoxy-2,3,5,6-tetramethylbenzeneNSC128393SCHEMBL11268433DTXSID30299142NSC-128393
Database identifiers
- CAS
56474-57-8- PubChem CID
- 278652
- DTXSID
DTXSID30299142- Nikkaji
- J606.096J
Properties
Computed structural properties
- XLogP
- 4
- Topological polar surface area
- 9.2 Ų
- Hydrogen bond donors
- 0
- Hydrogen bond acceptors
- 1
- Rotatable bonds
- 1
- Heavy atoms
- 13
- Formal charge
- 0
- Complexity
- 155
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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