Basic information
- CAS
65239-11-4- Standard SMILES
O=C(c1ccc(Br)cc1)c1nonc1C(=O)c1ccc(Br)cc1- InChIKey
ZLFIKYGHVNURLV-UHFFFAOYSA-N- Molecular formula
- C16H8Br2N2O3
- Average molar mass
- 436.05 g/mol
- Monoisotopic mass
- 433.89017
Names & identifiers
- Preferred name
- (1,2,5-Oxadiazole-3,4-diyl)bis[(4-bromophenyl)methanone]
- IUPAC
- [4-(4-bromobenzoyl)-1,2,5-oxadiazol-3-yl]-(4-bromophenyl)methanone
Names & synonyms
65239-11-4DTXSID10494830(1,2,5-Oxadiazole-3,4-diyl)bis[(4-bromophenyl)methanone]
Database identifiers
- CAS
65239-11-4- PubChem CID
- 12371248
- DTXSID
DTXSID10494830- Nikkaji
- J2.594.109H
Properties
Computed structural properties
- XLogP
- 4.5
- Topological polar surface area
- 73.1 Ų
- Hydrogen bond donors
- 0
- Hydrogen bond acceptors
- 5
- Rotatable bonds
- 4
- Heavy atoms
- 23
- Formal charge
- 0
- Complexity
- 407
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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