Basic information
- CAS
62681-99-6- Standard SMILES
Fc1cccc(-c2nnc(-c3cccc(F)c3)o2)c1- InChIKey
ROYCICSWSRZMRS-UHFFFAOYSA-N- Molecular formula
- C14H8F2N2O
- Average molar mass
- 258.22 g/mol
- Monoisotopic mass
- 258.06046921
Names & identifiers
- Preferred name
- 2,5-Bis(3-fluorophenyl)-1,3,4-oxadiazole
- IUPAC
- 2,5-bis(3-fluorophenyl)-1,3,4-oxadiazole
Names & synonyms
2,5-Bis(3-fluorophenyl)-1,3,4-oxadiazole62681-99-6EINECS 263-695-1DTXSID30211743NSC 90461RefChem:82702DTXCID60134234263-695-1BIS(3-FLUOROPHENYL)-1,3,4-OXADIAZOLENSC-904612,5-Di-(3-fluorophenyl)-1,3,4-oxadiazoleNSC90461
Show more names
6QL56L34TDROYCICSWSRZMRS-UHFFFAOYSA-NAKOS005081272FD6799512P-587SNS000553801,3,4-Oxadiazole, 2,5-bis(3-fluorophenyl)-
Database identifiers
- CAS
62681-99-6- PubChem CID
- 96857
- DTXSID
DTXSID30211743- UNII
- 6QL56L34TD
- EC Number
- 263-695-1
- Nikkaji
- J307.118I
Properties
Computed structural properties
- XLogP
- 3.3
- Topological polar surface area
- 38.9 Ų
- Hydrogen bond donors
- 0
- Hydrogen bond acceptors
- 5
- Rotatable bonds
- 2
- Heavy atoms
- 19
- Formal charge
- 0
- Complexity
- 277
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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