Piperazinium, 4-(4-tert-butyl-1-phenylcyclohexyl)-1,1-dimethyl-, iodide
Basic information
- CAS
21602-32-4- Standard SMILES
CI.CN1CCN(C2(c3ccccc3)CCC(C(C)(C)C)CC2)CC1- InChIKey
FPMKBTFPOZFXOV-UHFFFAOYSA-N- Molecular formula
- C22H37IN2
- Average molar mass
- 456.4 g/mol
- Monoisotopic mass
- 456.20015
Names & identifiers
- Preferred name
- Piperazinium, 4-(4-tert-butyl-1-phenylcyclohexyl)-1,1-dimethyl-, iodide
- IUPAC
- 1-(4-tert-butyl-1-phenylcyclohexyl)-4-methylpiperazine;iodomethane
Names & synonyms
21602-32-4Piperazinium, 4-(4-tert-butyl-1-phenylcyclohexyl)-1,1-dimethyl-, iodideDTXSID301759724-(4-tert-Butyl-1-phenylcyclohexyl)-1,1-dimethylpiperazinium, iodidePiperazine, 1-(4-tert-butyl-1-phenylcyclohexyl)-4-methyl-, monomethiodideRefChem:372764DTXCID60984631-(4-tert-Butyl-1-phenylcyclohexyl)-4-methylpiperazine--iodomethane (1/1)
Database identifiers
- CAS
21602-32-4- PubChem CID
- 210745
- DTXSID
DTXSID30175972
Properties
Computed structural properties
- Topological polar surface area
- 6.5 Ų
- Hydrogen bond donors
- 0
- Hydrogen bond acceptors
- 2
- Rotatable bonds
- 3
- Heavy atoms
- 25
- Formal charge
- 0
- Complexity
- 364
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Related reactions
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Compound notes
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