Basic information
- CAS
36911-94-1- Standard SMILES
CCc1cccc2cc3c(cc12)c(CC)cc1ccccc13- InChIKey
RHTUEBPQRSQIMX-UHFFFAOYSA-N- Molecular formula
- C22H20
- Average molar mass
- 284.4 g/mol
- Monoisotopic mass
- 284.15650064
Names & identifiers
- Preferred name
- Benz(a)anthracene, 6,8-diethyl-
- IUPAC
- 6,8-diethylbenzo[a]anthracene
- English name
- Benz(a)anthracene, 6,8-diethyl-
- Molecular weight
- 0
Names & synonyms
Benz(a)anthracene, 6,8-diethyl-6,8-Diethylbenz(a)anthraceneBRN 227498836911-94-16,8-Diethylbenz[a]anthraceneDTXSID00190394RefChem:117059DTXCID10112885RHTUEBPQRSQIMX-UHFFFAOYSA-N6,8-diethyltetraphene
Database identifiers
- CAS
36911-94-1- PubChem CID
- 215974
- DTXSID
DTXSID00190394- Nikkaji
- J35.524K
Properties
Computed structural properties
- XLogP
- 7.3
- 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
Physicochemical properties
- Boiling point
- 493.89 °C · 493.89°C (rough estimate)
- Density
- 1.056 · 1.0560 (estimate)
- refractive index
- 1.677 · 1.6770 (estimate)
- EWG's Food Scores
- 1 · 1
Chemistry & industry
Upstream & downstream products
Upstream raw materials
Suppliers1 total
HONEST JOY HOLDINGS LIMITED[email protected]
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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