Basic information
- Standard SMILES
CCn1nnnc1C(C=CC=O)=C(c1ccc(F)cc1)c1ccc(F)cc1- InChIKey
ZNBXNXCFZCHODU-UHFFFAOYSA-N- Molecular formula
- C20H16F2N4O
- Average molar mass
- 366.4 g/mol
Names & identifiers
- Preferred name
- 5,5-bis(4-fluorophenyl)-4-(1-ethyl-1H-tetrazol-5-yl)2,4-pentadienal
- IUPAC
- 4-(1-ethyltetrazol-5-yl)-5,5-bis(4-fluorophenyl)penta-2,4-dienal
Names & synonyms
SCHEMBL9726771ZNBXNXCFZCHODU-UHFFFAOYSA-N5,5-Bis(4-fluorophenyl)-4-(1-ethyl-1H-tetrazol-5-yl)-2,4-pentadienal5,5-bis(4-fluorophenyl)-4-(1-ethyl-1H-tetrazol-5-yl)2,4-pentadienal
Database identifiers
- PubChem CID
- 54555804
Properties
Computed structural properties
- XLogP
- 4.4
- Topological polar surface area
- 60.7 Ų
- Hydrogen bond donors
- 0
- Hydrogen bond acceptors
- 6
- Rotatable bonds
- 6
- Heavy atoms
- 27
- Formal charge
- 0
- Complexity
- 528
Related reactions
6 records
Compound notes
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