Basic information
- CAS
89210-89-9- Standard SMILES
CC(=O)O.Oc1ccc(OCCBr)cc1- InChIKey
PGUCLAHKRDTGDM-UHFFFAOYSA-N- Molecular formula
- C10H13BrO4
- Average molar mass
- 277.11 g/mol
- Monoisotopic mass
- 275.99972
Names & identifiers
- Preferred name
- Acetic acid;4-(2-bromoethoxy)phenol
- IUPAC
- acetic acid;4-(2-bromoethoxy)phenol
Names & synonyms
89210-89-9DTXSID60752396Acetic acid--4-(2-bromoethoxy)phenol (1/1)
Database identifiers
- CAS
89210-89-9- PubChem CID
- 71322745
- DTXSID
DTXSID60752396
Properties
Computed structural properties
- Topological polar surface area
- 66.8 Ų
- Hydrogen bond donors
- 2
- Hydrogen bond acceptors
- 4
- Rotatable bonds
- 3
- Heavy atoms
- 15
- Formal charge
- 0
- Complexity
- 131
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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