Basic information
- Standard SMILES
CCCc1c(OCCOCCOCCOCCBr)ccc(C(C)=O)c1O- InChIKey
FGKSKPXVXOBXHK-UHFFFAOYSA-N- Molecular formula
- C19H29BrO6
- Average molar mass
- 433.3 g/mol
- Monoisotopic mass
- 432.11475
Names & identifiers
- Preferred name
- 1-[4-[2-[2-[2-(2-Bromoethoxy)ethoxy]ethoxy]ethoxy]-2-hydroxy-3-propylphenyl]ethanone
- IUPAC
- 1-[4-[2-[2-[2-(2-bromoethoxy)ethoxy]ethoxy]ethoxy]-2-hydroxy-3-propylphenyl]ethanone
Names & synonyms
SCHEMBL10743998FGKSKPXVXOBXHK-UHFFFAOYSA-N1-[4-[2-[2-[2-(2-bromoethoxy)ethoxy]ethoxy]ethoxy]-2-hydroxy-3-propylphenyl]ethanone
Database identifiers
- PubChem CID
- 20197271
Properties
Computed structural properties
- XLogP
- 3.8
- Topological polar surface area
- 74.2 Ų
- Hydrogen bond donors
- 1
- Hydrogen bond acceptors
- 6
- Rotatable bonds
- 15
- Heavy atoms
- 26
- Formal charge
- 0
- Complexity
- 368
Related reactions
2 records
Compound notes
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