RefChem:1075223
2-[[2-(5-chloro-2-methylanilino)-2-phenylacetyl]amino]ethyl-dimethylazanium;(Z)-4-hydroxy-4-oxobut-2-enoate
Also Known As: LS-8699|Acetamide, 2-(5-chloro-o-toluidino)-N-(2-(dimethylamino)ethyl)-2-phenyl-, maleate|2-(5-Chloro-o-toluidino)-N-(2-(dimethylamino)ethyl)-2-phenylacetamide maleate|2-[[2-(5-chloro-2-methylanilino)-2-phenylacetyl]amino]ethyl-dimethylazanium; (Z)-4-hydroxy-4-oxobut-2-enoate
CAS: 97702-84-6
| Molecular Formula | C23H28ClN3O5 |
|---|---|
| Molecular Weight | 461.17175 g/mol |
| LogP | 0.43942 |
| Topological Polar Surface Area | 123.0 Ų |
| Hydrogen Bond Donors | 4 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 9 |
| Exact Mass | 461.17175 |
| Monoisotopic Mass | 461.17175 |
| Heavy Atoms | 32 |
| Complexity | 916.484 |
Chemical Identifiers
| CAS Number | 97702-84-6 |
|---|---|
| SMILES | CC1=C(C=C(C=C1)Cl)NC(C2=CC=CC=C2)C(=O)NCC[NH+](C)C.C(=C\C(=O)[O-])\C(=O)O |
Product Overview
RefChem:1075223 (CAS 97702-84-6), with molecular formula C23H28ClN3O5 and molecular weight 461.17175 g/mol. IUPAC: 2-[[2-(5-chloro-2-methylanilino)-2-phenylacetyl]amino]ethyl-dimethylazanium;(Z)-4-hydroxy-4-oxobut-2-enoate.
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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