Basic information
- CAS
5096-24-2- Standard SMILES
CCC1CCc2c1ccc1c(C)c3ccccc3cc21- InChIKey
LCRYYWPJVUWCSS-UHFFFAOYSA-N- Molecular formula
- C20H20
- Average molar mass
- 260.4 g/mol
- Monoisotopic mass
- 260.15650064
Names & identifiers
- Preferred name
- 3-Ethyl-2,3-dihydro-6-methyl-1H-cyclopent(a)anthracene
- IUPAC
- 3-ethyl-6-methyl-2,3-dihydro-1H-cyclopenta[a]anthracene
- English name
- 2,3-Dihydro-3-ethyl-6-methyl-cyclopenta[a]-anthracene
- Molecular formula
- C20H20
- Molecular weight
- 260.37
Names & synonyms
5096-24-2RefChem:10677363-Ethyl-2,3-dihydro-6-methyl-1H-cyclopent(a)anthracene2,3-Dihydro-3-ethyl-6-methyl-1H-cyclopenta(a)anthracene1H-Cyclopent(a)anthracene, 3-ethyl-2,3-dihydro-6-methyl-3-ethyl-6-methyl-2,3-dihydro-1H-cyclopenta[a]anthraceneDTXSID409652202,3-DIHYDRO-3-ETHYL-6-METHYL-CYCLOPENTA[A]-ANTHRACENE3-Ethyl-2,3-dihydro-6-methyl-1H-cyclopent[a]anthracene1H-Cyclopent[a]anthracene, 3-ethyl-2,3-dihydro-6-methyl-
Database identifiers
- CAS
5096-24-2- PubChem CID
- 199838
- DTXSID
DTXSID40965220- Nikkaji
- J34.898H
Properties
Computed structural properties
- XLogP
- 6.2
- Topological polar surface area
- 0 Ų
- Hydrogen bond donors
- 0
- Hydrogen bond acceptors
- 0
- Rotatable bonds
- 1
- Heavy atoms
- 20
- Formal charge
- 0
- Complexity
- 346
Physicochemical properties
- Boiling point
- 338.63 °C · 338.63°C (rough estimate)
- Density
- 1.023 · 1.0230 (estimate)
- refractive index
- 1.729 · 1.7290 (estimate)
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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