1,2,3,4-Tetraethyl-1,4,4a,9a-tetrahydroanthracene-9,10-dione
Basic information
- CAS
929217-67-4- Standard SMILES
CCC1=C(CC)C(CC)C2C(=O)c3ccccc3C(=O)C2C1CC- InChIKey
YMKLZQPEONOBRP-UHFFFAOYSA-N- Molecular formula
- C22H28O2
- Average molar mass
- 324.5 g/mol
- Monoisotopic mass
- 324.20893013
Names & identifiers
- Preferred name
- 1,2,3,4-Tetraethyl-1,4,4a,9a-tetrahydroanthracene-9,10-dione
- IUPAC
- 1,2,3,4-tetraethyl-1,4,4a,9a-tetrahydroanthracene-9,10-dione
Names & synonyms
929217-67-41,2,3,4-tetraethyl-1,4,4a,9a-tetrahydroanthracene-9,10-dioneDTXSID70853702
Database identifiers
- CAS
929217-67-4- PubChem CID
- 71445127
- DTXSID
DTXSID70853702
Properties
Computed structural properties
- XLogP
- 4.8
- Topological polar surface area
- 34.1 Ų
- Hydrogen bond donors
- 0
- Hydrogen bond acceptors
- 2
- Rotatable bonds
- 4
- Heavy atoms
- 24
- Formal charge
- 0
- Complexity
- 496
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Compound notes
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