Basic information
- CAS
40515-82-0- Standard SMILES
c1ccc(Oc2ccc3ccccc3n2)cc1- InChIKey
IDPWXVBDDIYDKT-UHFFFAOYSA-N- Molecular formula
- C15H11NO
- Average molar mass
- 221.25 g/mol
- Monoisotopic mass
- 221.08406397
Names & identifiers
- Preferred name
- 2-Phenoxyquinoline
- IUPAC
- 2-phenoxyquinoline
Names & synonyms
2-PhenoxyquinolineQuinoline, 2-phenoxy-40515-82-02-Phenoxy-quinolinephenoxyquinoline2-Phenoxyquinoline #CBDivE_002200MLS000693191SCHEMBL199906SCHEMBL4655065SCHEMBL4719366SCHEMBL8560759
Show more names
CHEMBL1426688SCHEMBL31595897DTXSID80346574IDPWXVBDDIYDKT-UHFFFAOYSA-NHMS2587I21AKOS000507425SMR000284617SR-01000389023
Database identifiers
- CAS
40515-82-0- PubChem CID
- 613302
- DTXSID
DTXSID80346574- ChEMBL
CHEMBL1426688- Nikkaji
- J1.694.358D
Properties
Computed structural properties
- XLogP
- 3.6
- Topological polar surface area
- 22.1 Ų
- Hydrogen bond donors
- 0
- Hydrogen bond acceptors
- 2
- Rotatable bonds
- 2
- Heavy atoms
- 17
- Formal charge
- 0
- Complexity
- 237
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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