Basic information
- CAS
40028-10-2- Standard SMILES
CI.CN1CCN(C(CCc2ccccc2)c2ccccc2)CC1- InChIKey
URVMEBAQOUFSNL-UHFFFAOYSA-N- Molecular formula
- C21H29IN2
- Average molar mass
- 436.4 g/mol
- Monoisotopic mass
- 436.13755
Names & identifiers
- Preferred name
- Piperazine, 1-(1,3-diphenylpropyl)-4-methyl-, compd. with iodomethane (1:1)
- IUPAC
- 1-(1,3-diphenylpropyl)-4-methylpiperazine;iodomethane
Names & synonyms
40028-10-2RefChem:1095689DTXSID809604911-(1,3-Diphenylpropyl)-4-methylpiperazine--iodomethane (1/1)
Database identifiers
- CAS
40028-10-2- PubChem CID
- 218005
- DTXSID
DTXSID80960491
Properties
Computed structural properties
- Topological polar surface area
- 6.5 Ų
- Hydrogen bond donors
- 0
- Hydrogen bond acceptors
- 2
- Rotatable bonds
- 5
- Heavy atoms
- 24
- Formal charge
- 0
- Complexity
- 299
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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