Basic information
- CAS
77979-28-3- Standard SMILES
Cc1cccc(-c2c3ccccc3cc3ccccc23)c1- InChIKey
JBNMQPMQGLINQM-UHFFFAOYSA-N- Molecular formula
- C21H16
- Average molar mass
- 268.4 g/mol
- Monoisotopic mass
- 268.12520051
Names & identifiers
- Preferred name
- 9-(3-Methylphenyl)anthracene
- IUPAC
- 9-(3-methylphenyl)anthracene
Names & synonyms
9-(3-methylphenyl)anthracene77979-28-3DTXSID70295067RefChem:312800DTXCID60246205NSC99479SCHEMBL27930163NSC-99479
Database identifiers
- CAS
77979-28-3- PubChem CID
- 264397
- DTXSID
DTXSID70295067- Nikkaji
- J3.338.069K
Properties
Computed structural properties
- XLogP
- 6.4
- Topological polar surface area
- 0 Ų
- Hydrogen bond donors
- 0
- Hydrogen bond acceptors
- 0
- Rotatable bonds
- 1
- Heavy atoms
- 21
- Formal charge
- 0
- Complexity
- 324
Related reactions
1 records
Compound notes
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