Basic information
- CAS
68723-60-4- Standard SMILES
Cc1ccc(-c2n[se]c(-c3ccc(C)cc3)n2)cc1- InChIKey
YXDHLPOURRVTKX-UHFFFAOYSA-N- Molecular formula
- C16H14N2Se
- Average molar mass
- 313.3 g/mol
- Monoisotopic mass
- 314.03222
Names & identifiers
- Preferred name
- 3,5-Bis(4-methylphenyl)-1,2,4-selenadiazole
- IUPAC
- 3,5-bis(4-methylphenyl)-1,2,4-selenadiazole
- English name
- 3,5-Bis(4-methylphenyl)-1,2,4-selenadiazole
- Molecular formula
- C16H14N2Se
- Molecular weight
- 313.26
Names & synonyms
3,5-Bis(4-methylphenyl)-1,2,4-selenadiazoleDTXSID9034583668723-60-4RefChem:271468DTXCID802969091,2,4-Selenadiazole, 3,5-bis(4-tolyl)-YXDHLPOURRVTKX-UHFFFAOYSA-N3,5-Bis(4-methylphenyl)-1,2,4-selenadiazole #1,2,4-Selenadiazole, 3,5-bis(4-methylphenyl)-
Database identifiers
- CAS
68723-60-4- PubChem CID
- 607458
- DTXSID
DTXSID90345836- Nikkaji
- J364.287I
Properties
Computed structural properties
- Topological polar surface area
- 25.8 Ų
- Hydrogen bond donors
- 0
- Hydrogen bond acceptors
- 2
- Rotatable bonds
- 2
- Heavy atoms
- 19
- Formal charge
- 0
- Complexity
- 280
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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