2-(5-Bromo-2-ethoxy-4-formylphenoxy)acetic acid
Basic information
- CAS
486994-21-2- Standard SMILES
CCOc1cc(C=O)c(Br)cc1OCC(=O)O- InChIKey
OHTAODBDCAKZJM-UHFFFAOYSA-N- Molecular formula
- C11H11BrO5
- Average molar mass
- 303.11 g/mol
- Monoisotopic mass
- 301.97899
Names & identifiers
- Preferred name
- 2-(5-Bromo-2-ethoxy-4-formylphenoxy)acetic acid
- IUPAC
- 2-(5-bromo-2-ethoxy-4-formylphenoxy)acetic acid
- English name
- (5-Bromo-2-ethoxy-4-formylphenoxy)acetic acid
- Molecular formula
- C11H11BrO5
- Molecular weight
- 303.11
Names & synonyms
2-(5-bromo-2-ethoxy-4-formylphenoxy)acetic acid(5-bromo-2-ethoxy-4-formylphenoxy)acetic acid486994-21-2AN-655/15531050SCHEMBL29955281DTXSID901241054AKOS000286193ST50715298AKOS B005229
Database identifiers
- CAS
486994-21-2- PubChem CID
- 819971
- DTXSID
DTXSID901241054
Properties
Computed structural properties
- XLogP
- 2
- Topological polar surface area
- 72.8 Ų
- Hydrogen bond donors
- 1
- Hydrogen bond acceptors
- 5
- Rotatable bonds
- 6
- Heavy atoms
- 17
- Formal charge
- 0
- Complexity
- 271
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Compound notes
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