3-chloro-N,N-dimethylcyclohexan-1-amine;2,4,6-trinitrophenol
Basic information
- CAS
7461-56-5- Standard SMILES
CN(C)C1CCCC(Cl)C1.O=[N+]([O-])c1cc([N+](=O)[O-])c(O)c([N+](=O)[O-])c1- InChIKey
RMCHIIRYNWWPSZ-UHFFFAOYSA-N- Molecular formula
- C14H19ClN4O7
- Average molar mass
- 390.77 g/mol
- Monoisotopic mass
- 390.0942267
Names & identifiers
- Preferred name
- 3-chloro-N,N-dimethylcyclohexan-1-amine;2,4,6-trinitrophenol
- IUPAC
- 3-chloro-N,N-dimethylcyclohexan-1-amine;2,4,6-trinitrophenol
Names & synonyms
7461-56-5NSC 403607NSC403607DTXSID90323336NSC-4036072,4,6-Trinitrophenol--3-chloro-N,N-dimethylcyclohexan-1-amine (1/1)
Database identifiers
- CAS
7461-56-5- PubChem CID
- 345820
- DTXSID
DTXSID90323336
Properties
Computed structural properties
- Topological polar surface area
- 161 Ų
- Hydrogen bond donors
- 1
- Hydrogen bond acceptors
- 8
- Rotatable bonds
- 1
- Heavy atoms
- 26
- Formal charge
- 0
- Complexity
- 395
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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