Basic information
- CAS
68047-38-1- Standard SMILES
Fc1cccc(-c2nnc(-c3cccc4ccccc34)o2)c1- InChIKey
JCBNEHLERQLNAO-UHFFFAOYSA-N- Molecular formula
- C18H11FN2O
- Average molar mass
- 290.3 g/mol
- Monoisotopic mass
- 290.08554114
Names & identifiers
- Preferred name
- 2-(3-Fluorophenyl)-5-(1-naphthyl)-1,3,4-oxadiazole
- IUPAC
- 2-(3-fluorophenyl)-5-naphthalen-1-yl-1,3,4-oxadiazole
Names & synonyms
2-(3-Fluorophenyl)-5-(1-naphthyl)-1,3,4-oxadiazole68047-38-1NSC-90477EINECS 268-289-8NSC90477NH6UQG3BZN2-(3-FLUOROPHENYL)-5-(NAPHTHALEN-1-YL)-1,3,4-OXADIAZOLEDTXSID40218223JCBNEHLERQLNAO-UHFFFAOYSA-NNSC 90477NS00063418
Database identifiers
- CAS
68047-38-1- PubChem CID
- 96861
- DTXSID
DTXSID40218223- UNII
- NH6UQG3BZN
- EC Number
- 268-289-8
- Nikkaji
- J288.977C
Properties
Computed structural properties
- XLogP
- 4.4
- Topological polar surface area
- 38.9 Ų
- Hydrogen bond donors
- 0
- Hydrogen bond acceptors
- 4
- Rotatable bonds
- 2
- Heavy atoms
- 22
- Formal charge
- 0
- Complexity
- 380
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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