Basic information
- CAS
60444-70-4- Standard SMILES
CN1C(Cl)C=C(C2CCCCC2)[NH+]1C.[O-][Cl+3]([O-])([O-])[O-]- InChIKey
PXPCJIHGSYYIBO-UHFFFAOYSA-N- Molecular formula
- C11H20Cl2N2O4
- Average molar mass
- 315.19 g/mol
- Monoisotopic mass
- 314.0800125
Names & identifiers
- Preferred name
- 3-Chloro-5-cyclohexyl-1,2-dimethyl-2,3-dihydro-1H-pyrazol-1-ium perchlorate
- IUPAC
- 3-chloro-5-cyclohexyl-1,2-dimethyl-1,3-dihydropyrazol-1-ium perchlorate
Names & synonyms
60444-70-4DTXSID508220723-Chloro-5-cyclohexyl-1,2-dimethyl-2,3-dihydro-1H-pyrazol-1-ium perchlorate
Database identifiers
- CAS
60444-70-4- PubChem CID
- 71400829
- DTXSID
DTXSID50822072
Properties
Computed structural properties
- Topological polar surface area
- 82 Ų
- Hydrogen bond donors
- 1
- Hydrogen bond acceptors
- 5
- Rotatable bonds
- 1
- Heavy atoms
- 19
- Formal charge
- 0
- Complexity
- 329
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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