Basic information
- Standard SMILES
CC(C)CCC(C)NC1=CC(=O)C(NC(C)CCC(C)C)=CC1=O- InChIKey
FTQQIEGSVVPQBX-UHFFFAOYSA-N- Molecular formula
- C20H34N2O2
- Average molar mass
- 334.5 g/mol
- Monoisotopic mass
- 334.26202833
Names & identifiers
- Preferred name
- 77PD-quinone
- IUPAC
- 2,5-bis(5-methylhexan-2-ylamino)cyclohexa-2,5-diene-1,4-dione
Names & synonyms
3078541-61-177PD-quinone77PD-Qorb3136265DTXSID801352923T2118802,5-Bis[(5-methylhexan-2-yl)amino]-1,4-benzoquinone
Database identifiers
- PubChem CID
- 175663235
- DTXSID
DTXSID801352923
Properties
Computed structural properties
- XLogP
- 5.4
- Topological polar surface area
- 58.2 Ų
- Hydrogen bond donors
- 2
- Hydrogen bond acceptors
- 4
- Rotatable bonds
- 10
- Heavy atoms
- 24
- Formal charge
- 0
- Complexity
- 458
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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