Basic information
- CAS
130-60-9- Standard SMILES
O=[N+]([O-])c1cc(C2CCCCC2)c([O-])c([N+](=O)[O-])c1.[Na+]- InChIKey
ZPJNODIYCJVPHX-UHFFFAOYSA-M- Molecular formula
- C12H13N2NaO5
- Average molar mass
- 288.23 g/mol
- Monoisotopic mass
- 288.0722158
Names & identifiers
- Preferred name
- 2-Cyclohexyl-4,6-dinitrophenol, sodium salt
- IUPAC
- sodium 2-cyclohexyl-4,6-dinitrophenolate
Names & synonyms
2-CYCLOHEXYL-4,6-DINITROPHENOL, SODIUM SALT130-60-9sodium 2-cyclohexyl-4,6-dinitrophenolateDTXSID70156280
Database identifiers
- CAS
130-60-9- PubChem CID
- 8539
- DTXSID
DTXSID70156280
Properties
Computed structural properties
- Topological polar surface area
- 115 Ų
- Hydrogen bond donors
- 0
- Hydrogen bond acceptors
- 5
- Rotatable bonds
- 1
- Heavy atoms
- 20
- Formal charge
- 0
- Complexity
- 345
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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