3-(2-Bromophenyl)-5-(2-chlorophenyl)-1,2,4-oxadiazole
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Basic information
- CAS
1000339-28-5- Standard SMILES
Clc1ccccc1-c1nc(-c2ccccc2Br)no1- InChIKey
QXTCOSGKUMUJDY-UHFFFAOYSA-N- Molecular formula
- C14H8BrClN2O
- Average molar mass
- 335.58 g/mol
- Monoisotopic mass
- 333.95085
Names & identifiers
- Preferred name
- 3-(2-Bromophenyl)-5-(2-chlorophenyl)-1,2,4-oxadiazole
- IUPAC
- 3-(2-bromophenyl)-5-(2-chlorophenyl)-1,2,4-oxadiazole
- English name
- 3-(2-Bromophenyl)-5-(2-chlorophenyl)-1,2,4-oxadiazole
- Molecular formula
- C14H8BrClN2O
- Molecular weight
- 335.58312
Names & synonyms
3-(2-Bromophenyl)-5-(2-chlorophenyl)-1,2,4-oxadiazole1000339-28-5MFCD022174491,2,4-Oxadiazole, 3-(2-bromophenyl)-5-(2-chlorophenyl)-DTXSID40650341AKOS015835130BS-18991CS-0439539
Database identifiers
- CAS
1000339-28-5- PubChem CID
- 26967039
- DTXSID
DTXSID40650341
Properties
Computed structural propertiesFilling in
- XLogP
- 4.8
- Topological polar surface area
- 38.9 Ų
- Hydrogen bond donors
- 0
- Hydrogen bond acceptors
- 3
- Rotatable bonds
- 2
- Heavy atoms
- 19
- Formal charge
- 0
- Complexity
- 307
Related reactions
0 records
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Compound notes
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