9,10-Anthracenedione, 1-chloro-8-[(2-hydroxyethyl)amino]-
Basic information
- CAS
97968-56-4- Standard SMILES
O=C1c2cccc(Cl)c2C(=O)c2c(NCCO)cccc21- InChIKey
HWIHNDBKOOONGA-UHFFFAOYSA-N- Molecular formula
- C16H12ClNO3
- Average molar mass
- 301.72 g/mol
- Monoisotopic mass
- 301.0505709
Names & identifiers
- Preferred name
- 9,10-Anthracenedione, 1-chloro-8-[(2-hydroxyethyl)amino]-
- IUPAC
- 1-chloro-8-(2-hydroxyethylamino)anthracene-9,10-dione
Names & synonyms
97968-56-41-Chloro-8-((2-hydroxyethyl)amino)anthracene-9,10-dione1-chloro-8-[(2-hydroxyethyl)amino]anthracene-9,10-dione9,10-Anthracenedione, 1-chloro-8-[(2-hydroxyethyl)amino]-NSC162541DTXSID50303836NSC-162541
Database identifiers
- CAS
97968-56-4- PubChem CID
- 294389
- DTXSID
DTXSID50303836
Properties
Computed structural properties
- XLogP
- 3.3
- Topological polar surface area
- 66.4 Ų
- Hydrogen bond donors
- 2
- Hydrogen bond acceptors
- 4
- Rotatable bonds
- 3
- Heavy atoms
- 21
- Formal charge
- 0
- Complexity
- 428
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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