RefChem:1056643
3-[4-[(2-benzylphenyl)methyl]piperazin-1-yl]propanenitrile;(E)-but-2-enedioic acid
Also Known As: 1-(2-Benzylbenzyl)-4-(2-cyanoethyl)piperazine maleate|1-Piperazinepropanenitrile, 4-((2-(phenylmethyl)phenyl)methyl)-, (Z)-2-butenedioate (1:1)|4-((2-(Phenylmethyl)phenyl)methyl)-1-piperazinepropanenitrile maleate|3-[4-[(2-benzylphenyl)methyl]piperazin-1-yl]propanenitrile; (E)-but-2-enedioic acid
CAS: 37652-66-7
| Molecular Formula | C25H29N3O4 |
|---|---|
| Molecular Weight | 435.21582 g/mol |
| LogP | 3.02048 |
| Topological Polar Surface Area | 104.87 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 8 |
| Exact Mass | 435.21582 |
| Monoisotopic Mass | 435.21582 |
| Heavy Atoms | 32 |
| Complexity | 913.70325 |
Chemical Identifiers
| CAS Number | 37652-66-7 |
|---|---|
| SMILES | C1CN(CCN1CCC#N)CC2=CC=CC=C2CC3=CC=CC=C3.C(=C/C(=O)O)\C(=O)O |
Product Overview
RefChem:1056643 (CAS 37652-66-7), with molecular formula C25H29N3O4 and molecular weight 435.21582 g/mol. IUPAC: 3-[4-[(2-benzylphenyl)methyl]piperazin-1-yl]propanenitrile;(E)-but-2-enedioic acid.
Safety Data Sheet (MSDS / SDS)
View the Laboratory Chemical Safety Summary (LCSS) on PubChem — includes GHS classifications, hazard statements, first aid measures, and handling precautions.
View MSDS →
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