p-Benzoquinone, 2-((2-(diethylamino)ethyl)amino)-
Basic information
- CAS
23434-53-9- Standard SMILES
CCN(CC)CCNC1=CC(=O)C=CC1=O- InChIKey
HSQXMQBGYMQEPA-UHFFFAOYSA-N- Molecular formula
- C12H18N2O2
- Average molar mass
- 222.28 g/mol
- Monoisotopic mass
- 222.13682782
Names & identifiers
- Preferred name
- p-Benzoquinone, 2-((2-(diethylamino)ethyl)amino)-
- IUPAC
- 2-[2-(diethylamino)ethylamino]cyclohexa-2,5-diene-1,4-dione
Names & synonyms
BRN 2972533p-Benzoquinone, 2-((2-(diethylamino)ethyl)amino)-23434-53-92-((2-(Diethylamino)ethyl)amino)-p-benzoquinoneDTXSID401779872,5-Cyclohexadiene-1,4-dione, 2-((2-(diethylamino)ethyl)amino)-4-14-00-00364 (Beilstein Handbook Reference)RefChem:367597DTXCID001004782-{[2-(diethylamino)ethyl]amino}cyclohexa-2,5-diene-1,4-dione
Database identifiers
- CAS
23434-53-9- PubChem CID
- 211595
- DTXSID
DTXSID40177987
Properties
Computed structural properties
- XLogP
- 1
- Topological polar surface area
- 49.4 Ų
- Hydrogen bond donors
- 1
- Hydrogen bond acceptors
- 4
- Rotatable bonds
- 6
- Heavy atoms
- 16
- Formal charge
- 0
- Complexity
- 328
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Compound notes
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