1,8-Bis[(2-hydroxyethyl)amino]anthracene-9,10-dione
Basic information
- CAS
75312-66-2- Standard SMILES
O=C1c2cccc(NCCO)c2C(=O)c2c(NCCO)cccc21- InChIKey
NERFPNHSRWWSBD-UHFFFAOYSA-N- Molecular formula
- C18H18N2O4
- Average molar mass
- 326.3 g/mol
- Monoisotopic mass
- 326.12665706
Names & identifiers
- Preferred name
- 1,8-Bis[(2-hydroxyethyl)amino]anthracene-9,10-dione
- IUPAC
- 1,8-bis(2-hydroxyethylamino)anthracene-9,10-dione
Names & synonyms
75312-66-21,8-bis[(2-hydroxyethyl)amino]anthracene-9,10-dione1,8-Bis((2-hydroxyethyl)amino)anthracene-9,10-dioneNSC162540SCHEMBL20333890SCHEMBL41363963DTXSID90303835AKOS005145390NSC-1625409, 1,8-bis[(2-hydroxyethyl)amino]-
Database identifiers
- CAS
75312-66-2- PubChem CID
- 294388
- DTXSID
DTXSID90303835- Nikkaji
- J426.743E
Properties
Computed structural properties
- XLogP
- 2
- Topological polar surface area
- 98.7 Ų
- Hydrogen bond donors
- 4
- Hydrogen bond acceptors
- 6
- Rotatable bonds
- 6
- Heavy atoms
- 24
- Formal charge
- 0
- Complexity
- 432
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Related reactions
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Compound notes
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