Basic information
- CAS
16354-54-4- Standard SMILES
CCCc1c2ccccc2c(C)c2c1ccc1ccccc12- InChIKey
YQKGLNLJXKJWSN-UHFFFAOYSA-N- Molecular formula
- C22H20
- Average molar mass
- 284.4 g/mol
- Monoisotopic mass
- 284.15650064
Names & identifiers
- Preferred name
- Benz(a)anthracene, 12-methyl-7-propyl-
- IUPAC
- 12-methyl-7-propylbenzo[a]anthracene
Names & synonyms
Benz(a)anthracene, 12-methyl-7-propyl-12-Methyl-7-propylbenz(a)anthraceneBRN 331761512-Methyl-7-propylbenz[a]anthracene16354-54-4DTXSID101676134-05-00-02603 (Beilstein Handbook Reference)RefChem:117057DTXCID2090104YQKGLNLJXKJWSN-UHFFFAOYSA-N12-METHYL-7-PROPYLTETRAPHENE
Database identifiers
- CAS
16354-54-4- PubChem CID
- 85376
- DTXSID
DTXSID10167613- Nikkaji
- J35.572K
Properties
Computed structural properties
- XLogP
- 6.8
- Topological polar surface area
- 0 Ų
- Hydrogen bond donors
- 0
- Hydrogen bond acceptors
- 0
- Rotatable bonds
- 2
- Heavy atoms
- 22
- Formal charge
- 0
- Complexity
- 372
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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