Basic information
- Standard SMILES
COc1ccc(-c2cc(Br)c(-c3ccc(OC)c(OC)c3)s2)cc1OC- InChIKey
UNNFAJKSMCQLTO-UHFFFAOYSA-N- Molecular formula
- C20H19BrO4S
- Average molar mass
- 435.3 g/mol
Names & identifiers
- Preferred name
- 3-Bromo-2,5-bis(3',4'-dimethoxyphenyl)thiophene
- IUPAC
- 3-bromo-2,5-bis(3,4-dimethoxyphenyl)thiophene
Names & synonyms
SCHEMBL12497249UNNFAJKSMCQLTO-UHFFFAOYSA-N3-bromo-2,5-bis(3',4'-dimethoxyphenyl)thiophene
Database identifiers
- PubChem CID
- 68294091
Properties
Computed structural properties
- XLogP
- 5.5
- Topological polar surface area
- 65.2 Ų
- Hydrogen bond donors
- 0
- Hydrogen bond acceptors
- 5
- Rotatable bonds
- 6
- Heavy atoms
- 26
- Formal charge
- 0
- Complexity
- 440
Related reactions
3 records
Compound notes
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