6-Bromo-4-ethyl-7-ethoxy-2,2-dimethyl-2H-chromene
Basic information
- Standard SMILES
CCOc1cc2c(cc1Br)C(CC)=CC(C)(C)O2- InChIKey
QMMCHZKHTXCYQK-UHFFFAOYSA-N- Molecular formula
- C15H19BrO2
- Average molar mass
- 311.21 g/mol
Names & identifiers
- Preferred name
- 6-Bromo-4-ethyl-7-ethoxy-2,2-dimethyl-2H-chromene
- IUPAC
- 6-bromo-7-ethoxy-4-ethyl-2,2-dimethylchromene
Names & synonyms
SCHEMBL6279983QMMCHZKHTXCYQK-UHFFFAOYSA-N6-Bromo-4-ethyl-7-ethoxy-2,2-dimethyl-2H-chromene
Database identifiers
- PubChem CID
- 22490974
Properties
Computed structural properties
- XLogP
- 4.2
- Topological polar surface area
- 18.5 Ų
- Hydrogen bond donors
- 0
- Hydrogen bond acceptors
- 2
- Rotatable bonds
- 3
- Heavy atoms
- 18
- Formal charge
- 0
- Complexity
- 324
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Related reactions
3 records
Compound notes
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