Basic information
- CAS
63856-81-5- Standard SMILES
COc1ccc(C(=O)Cc2cc(OC)c(OC)cc2Br)cc1OC- InChIKey
MBKYCTDVQRBUEK-UHFFFAOYSA-N- Molecular formula
- C18H19BrO5
- Average molar mass
- 395.2 g/mol
- Monoisotopic mass
- 394.04159
Names & identifiers
- Preferred name
- 2-(2-Bromo-4,5-dimethoxyphenyl)-1-(3,4-dimethoxyphenyl)ethanone
- IUPAC
- 2-(2-bromo-4,5-dimethoxyphenyl)-1-(3,4-dimethoxyphenyl)ethanone
Names & synonyms
2-(2-bromo-4,5-dimethoxyphenyl)-1-(3,4-dimethoxyphenyl)ethanone63856-81-5STK093785NSC345774Cambridge id 5653007DTXSID90319476NSC611190AKOS004117349NSC-345774NSC-611190AB00091879-01SR-01000215948
Show more names
SR-01000215948-12-(2-Bromo-4,5-dimethoxyphenyl)-1-(3,4-dimethoxyphenyl)ethan-1-one
Database identifiers
- CAS
63856-81-5- PubChem CID
- 335604
- DTXSID
DTXSID90319476
Properties
Computed structural properties
- XLogP
- 3.8
- Topological polar surface area
- 54 Ų
- Hydrogen bond donors
- 0
- Hydrogen bond acceptors
- 5
- Rotatable bonds
- 7
- Heavy atoms
- 24
- Formal charge
- 0
- Complexity
- 405
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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