Basic information
- Standard SMILES
O=C1c2ccccc2C(=O)c2c(OCCOCCOCCOCCO)cccc21- InChIKey
ATKCQBLKOUWYQX-UHFFFAOYSA-N- Molecular formula
- C22H24O7
- Average molar mass
- 400.4 g/mol
- Monoisotopic mass
- 400.1522031
Names & identifiers
- Preferred name
- 1-[2-[2-[2-(2-Hydroxyethoxy)ethoxy]ethoxy]ethoxy]-9,10-anthraquinone
- IUPAC
- 1-[2-[2-[2-(2-hydroxyethoxy)ethoxy]ethoxy]ethoxy]anthracene-9,10-dione
Names & synonyms
SCHEMBL6333924ATKCQBLKOUWYQX-UHFFFAOYSA-N1-[2-[2-[2-(2-hydroxyethoxy)ethoxy]ethoxy]ethoxy]-9,10-anthraquinone
Database identifiers
- PubChem CID
- 22315914
- Nikkaji
- J3.154.023B
Properties
Computed structural properties
- XLogP
- 2.2
- Topological polar surface area
- 91.3 Ų
- Hydrogen bond donors
- 1
- Hydrogen bond acceptors
- 7
- Rotatable bonds
- 12
- Heavy atoms
- 29
- Formal charge
- 0
- Complexity
- 523
Related reactions
2 records
Linked notes
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