Basic information
- CAS
91844-22-3- Standard SMILES
Oc1ccc(COCCBr)c2cccnc12- InChIKey
BBHKFUWMMXHGDG-UHFFFAOYSA-N- Molecular formula
- C12H12BrNO2
- Average molar mass
- 282.13 g/mol
- Monoisotopic mass
- 281.00514
Names & identifiers
- Preferred name
- 5-[(2-Bromoethoxy)methyl]quinolin-8-ol
- IUPAC
- 5-(2-bromoethoxymethyl)quinolin-8-ol
Names & synonyms
91844-22-35-[(2-bromoethoxy)methyl]quinolin-8-ol5-((2-Bromoethoxy)methyl)quinolin-8-olNSC130878SCHEMBL3133506DTXSID00299457NSC-130878
Database identifiers
- CAS
91844-22-3- PubChem CID
- 279652
- DTXSID
DTXSID00299457
Properties
Computed structural properties
- XLogP
- 2.4
- Topological polar surface area
- 42.4 Ų
- Hydrogen bond donors
- 1
- Hydrogen bond acceptors
- 3
- Rotatable bonds
- 4
- Heavy atoms
- 16
- Formal charge
- 0
- Complexity
- 215
Related reactions
0 records
No reaction records under the current filter.
Compound notes
Loading…