3-(4-Bromophenyl)-5-(4-chlorophenyl)-1,2,4-oxadiazole
Basic information
- CAS
489435-05-4- Standard SMILES
Clc1ccc(-c2nc(-c3ccc(Br)cc3)no2)cc1- InChIKey
CAOVZBCCDYEKCE-UHFFFAOYSA-N- Molecular formula
- C14H8BrClN2O
- Average molar mass
- 335.58 g/mol
- Monoisotopic mass
- 333.95085
Names & identifiers
- Preferred name
- 3-(4-Bromophenyl)-5-(4-chlorophenyl)-1,2,4-oxadiazole
- IUPAC
- 3-(4-bromophenyl)-5-(4-chlorophenyl)-1,2,4-oxadiazole
- English name
- 3-(4-bromophenyl)-5-(4-chlorophenyl)-1,2,4-oxadiazole
- Molecular formula
- C14H8BrClN2O
- Molecular weight
- 335.58
Names & synonyms
3-(4-bromophenyl)-5-(4-chlorophenyl)-1,2,4-oxadiazole489435-05-4MFCD04088916DTXSID50356403AKOS015835666BS-22980CS-02126301,2,4-Oxadiazole, 3-(4-bromophenyl)-5-(4-chlorophenyl)-
Database identifiers
- CAS
489435-05-4- PubChem CID
- 823328
- DTXSID
DTXSID50356403
Properties
Computed structural properties
- XLogP
- 5
- 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
- 291
Physicochemical properties
- storage temp.
- 2 · 2-8°C
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Compound notes
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