(4-Methyl-2-oxo-1-propan-2-ylcyclohexyl)-[(4-methyl-2-oxo-1-propan-2-ylcyclohexyl)-oxidoamino]-oxoazanium
Basic information
- CAS
59183-14-1- Standard SMILES
CC1CCC(C(C)C)(N([O-])[N+](=O)C2(C(C)C)CCC(C)CC2=O)C(=O)C1- InChIKey
JHGWEYPUEIQVGA-UHFFFAOYSA-N- Molecular formula
- C20H34N2O4
- Average molar mass
- 366.5 g/mol
- Monoisotopic mass
- 366.25185757
Names & identifiers
- Preferred name
- (4-Methyl-2-oxo-1-propan-2-ylcyclohexyl)-[(4-methyl-2-oxo-1-propan-2-ylcyclohexyl)-oxidoamino]-oxoazanium
- IUPAC
- (4-methyl-2-oxo-1-propan-2-ylcyclohexyl)-[(4-methyl-2-oxo-1-propan-2-ylcyclohexyl)-oxidoamino]-oxoazanium
Database identifiers
- CAS
59183-14-1- PubChem CID
- 322221
- DTXSID
DTXSID20313922
Properties
Computed structural properties
- XLogP
- 4.1
- Topological polar surface area
- 80.5 Ų
- Hydrogen bond donors
- 0
- Hydrogen bond acceptors
- 5
- Rotatable bonds
- 5
- Heavy atoms
- 26
- Formal charge
- 0
- Complexity
- 539
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Compound notes
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