Basic information
- CAS
62681-98-5- Standard SMILES
Fc1ccccc1-c1nnc(-c2ccccc2F)o1- InChIKey
HOVHSZHGKDKRMF-UHFFFAOYSA-N- Molecular formula
- C14H8F2N2O
- Average molar mass
- 258.22 g/mol
- Monoisotopic mass
- 258.06046921
Names & identifiers
- Preferred name
- 2,5-Bis(2-fluorophenyl)-1,3,4-oxadiazole
- IUPAC
- 2,5-bis(2-fluorophenyl)-1,3,4-oxadiazole
- English name
- 2,5-Bis(2-fluorophenyl)-1,3,4-oxadiazole 99
- Molecular formula
- C14H8F2N2O
- Molecular weight
- 258.22
Names & synonyms
2,5-Bis(2-fluorophenyl)-1,3,4-oxadiazole62681-98-5EINECS 263-694-61,3,4-Oxadiazole, 2,5-bis(2-fluorophenyl)-2,5-di-(2-Fluorophenyl)oxadiazole-1,3,4DTXSID70211742NSC 904602,5-di-(2-Fluorophenyl)-1,3,4-oxadiazoleRefChem:82699DTXCID00134233263-694-6HOVHSZHGKDKRMF-UHFFFAOYSA-N
Show more names
2,5-Bis(2-fluorophenyl)-1,3,4-oxadiazole 992,5-Bis(2-fluorophenyl)-1,3,4-oxadiazole 99%
NSC-90460NSC90460N2R96AV9GPSCHEMBL6451424SCHEMBL38677366SBB101992AKOS0243710762,5-bis(fluorophenyl)-1,3,4-oxadiazole
Database identifiers
- CAS
62681-98-5- PubChem CID
- 96856
- DTXSID
DTXSID70211742- UNII
- N2R96AV9GP
- EC Number
- 263-694-6
- Nikkaji
- J307.117K
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
Physicochemical properties
- Melting point
- 118 · 118-120
- Hazard Codes
- Xi
- Hazard Note
- Irritant
- HS Code
- 2934999090 · 2934999090
Safety & regulation
Safety information is for reference only and does not replace the supplier’s Safety Data Sheet (SDS), applicable regulations, or professional assessment.
Safety data
- hs_code
- 2934999090
- hazard_code
- Xi
- hazard_note
- Irritant
Chemistry & industry
Suppliers2 total
APOLLO-NMR[email protected]
Service Chemical Inc.[email protected]
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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