Piperazinium, 1,1-dimethyl-4-(4-methyl-1-phenylcyclohexyl)-, iodode
Basic information
- CAS
21602-29-9- Standard SMILES
CC1CCC(c2ccccc2)(N2CCN(C)CC2)CC1.CI- InChIKey
SIDPGRYHNJKNQZ-UHFFFAOYSA-N- Molecular formula
- C19H31IN2
- Average molar mass
- 414.4 g/mol
- Monoisotopic mass
- 414.1532
Names & identifiers
- Preferred name
- Piperazinium, 1,1-dimethyl-4-(4-methyl-1-phenylcyclohexyl)-, iodode
- IUPAC
- iodomethane;1-methyl-4-(4-methyl-1-phenylcyclohexyl)piperazine
Names & synonyms
21602-29-91,1-Dimethyl-4-(4-methyl-1-phenylcyclohexyl)piperazinium, iodideDTXSID10175970Piperazinium, 1,1-dimethyl-4-(4-methyl-1-phenylcyclohexyl)-, iododePiperazine, 1-methyl-4-(4-methyl-1-phenylcyclohexyl)-, monomethiodideRefChem:372733DTXCID60984611-Methyl-4-(4-methyl-1-phenylcyclohexyl)piperazine--iodomethane (1/1)
Database identifiers
- CAS
21602-29-9- PubChem CID
- 210741
- DTXSID
DTXSID10175970
Properties
Computed structural properties
- Topological polar surface area
- 6.5 Ų
- Hydrogen bond donors
- 0
- Hydrogen bond acceptors
- 2
- Rotatable bonds
- 2
- Heavy atoms
- 22
- Formal charge
- 0
- Complexity
- 295
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Related reactions
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Compound notes
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