Basic information
- Standard SMILES
Cc1ccc(-c2ccc3ccc4c(-c5ccc(C)cc5)cc(-c5ccc(C)cc5)c5ccc2c3c45)cc1- InChIKey
XKTXXTIUPMGPJM-UHFFFAOYSA-N- Molecular formula
- C37H28
- Average molar mass
- 472.6 g/mol
Names & identifiers
- Preferred name
- 1,3,6-Tri(4-methylphenyl)pyrene
- IUPAC
- 1,3,6-tris(4-methylphenyl)pyrene
Names & synonyms
SCHEMBL2083685XKTXXTIUPMGPJM-UHFFFAOYSA-N1,3,6-tri(4-methylphenyl)pyrene
Database identifiers
- PubChem CID
- 86628591
Properties
Computed structural properties
- XLogP
- 11
- Topological polar surface area
- 0 Ų
- Hydrogen bond donors
- 0
- Hydrogen bond acceptors
- 0
- Rotatable bonds
- 3
- Heavy atoms
- 37
- Formal charge
- 0
- Complexity
- 744
Related reactions
4 records
Compound notes
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