Basic information
- CAS
66271-47-4- Standard SMILES
Cc1ccc(C)c2c1ccc1cccc(C)c12- InChIKey
ZPVMMYYWEOIYFV-UHFFFAOYSA-N- Molecular formula
- C17H16
- Average molar mass
- 220.31 g/mol
- Monoisotopic mass
- 220.12520051
Names & identifiers
- Preferred name
- 1,4,5-Trimethylphenanthrene
- IUPAC
- 1,4,5-trimethylphenanthrene
Names & synonyms
1,4,5-trimethylphenanthrene66271-47-4NSC408576Phenanthrene,4,5-trimethyl-DTXSID00325083NSC-408576DS-008385
Database identifiers
- CAS
66271-47-4- PubChem CID
- 349028
- DTXSID
DTXSID00325083
Properties
Computed structural properties
- XLogP
- 6.1
- Topological polar surface area
- 0 Ų
- Hydrogen bond donors
- 0
- Hydrogen bond acceptors
- 0
- Rotatable bonds
- 0
- Heavy atoms
- 17
- Formal charge
- 0
- Complexity
- 269
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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