Basic information
- CAS
37652-62-3- Standard SMILES
C=CCN1CCN(Cc2ccccc2Cc2ccccc2)CC1.O=C(O)/C=C/C(=O)O.O=C(O)/C=C/C(=O)O- InChIKey
SJUNHRMYBWNWJH-LVEZLNDCSA-N- Molecular formula
- C29H34N2O8
- Average molar mass
- 538.6 g/mol
- Monoisotopic mass
- 538.23151605
Names & identifiers
- Preferred name
- Piperazine, 1-((2-(phenylmethyl)phenyl)methyl)-4-(2-propenyl)-, (z)-2-butenedioate (1:2)
- IUPAC
- 1-[(2-benzylphenyl)methyl]-4-prop-2-enylpiperazine;bis((E)-but-2-enedioic acid)
Names & synonyms
Piperazine, 1-((2-(phenylmethyl)phenyl)methyl)-4-(2-propenyl)-, (z)-2-butenedioate (1:2)37652-62-3RefChem:10956581-((2-(Phenylmethyl)phenyl)methyl)-4-(2-propenyl)piperazine dimaleate
Database identifiers
- CAS
37652-62-3- PubChem CID
- 6445596
Properties
Computed structural properties
- Topological polar surface area
- 156 Ų
- Hydrogen bond donors
- 4
- Hydrogen bond acceptors
- 10
- Rotatable bonds
- 10
- Heavy atoms
- 39
- Formal charge
- 0
- Complexity
- 459
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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