2-Ethyl-1,2,3,4-tetrahydroanthraquinone
Basic information
- CAS
52651-49-7- Standard SMILES
CCC1CCC2=C(C1)C(=O)c1ccccc1C2=O- InChIKey
JORLUGVBYJSSAW-UHFFFAOYSA-N- Molecular formula
- C16H16O2
- Average molar mass
- 240.3 g/mol
- Monoisotopic mass
- 240.11502975
Names & identifiers
- Preferred name
- 2-Ethyl-1,2,3,4-tetrahydroanthraquinone
- IUPAC
- 2-ethyl-1,2,3,4-tetrahydroanthracene-9,10-dione
Names & synonyms
NSC175532-ethyl-1,2,3,4-tetrahydroanthraquinone52651-49-7SCHEMBL183347SCHEMBL30393799NSC-1755328555-16-0
Database identifiers
- CAS
52651-49-7- PubChem CID
- 226785
- Nikkaji
- J2.044.763J
Properties
Computed structural properties
- XLogP
- 3.6
- Topological polar surface area
- 34.1 Ų
- Hydrogen bond donors
- 0
- Hydrogen bond acceptors
- 2
- Rotatable bonds
- 1
- Heavy atoms
- 18
- Formal charge
- 0
- Complexity
- 419
Related reactions
0 records
No reaction records under the current filter.
Compound notes
Loading…