Diethyl 2-[[4-(bromomethyl)benzoyl]amino]pentanedioate
diethyl 2-[[4-(bromomethyl)benzoyl]amino]pentanedioate
Also Known As: diethyl 2-[[4-(bromomethyl)benzoyl]amino]pentanedioate|Diethyl N-[4-(bromomethyl)benzoyl]glutamate
CAS: 70583-33-4
| Molecular Formula | C17H22BrNO5 |
|---|---|
| Molecular Weight | 399.06815 g/mol |
| LogP | 2.6 |
| Topological Polar Surface Area | 81.7 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 11 |
| Exact Mass | 399.06815 |
| Monoisotopic Mass | 399.06815 |
| Heavy Atoms | 24 |
| Complexity | 421.0 |
Chemical Identifiers
| CAS Number | 70583-33-4 |
|---|---|
| SMILES | CCOC(=O)CCC(C(=O)OCC)NC(=O)C1=CC=C(C=C1)CBr |
| InChIKey | TWPIQHUQGNKXGI-UHFFFAOYSA-N |
Patent-Derived Application Labels
Derived from 2 IPC patent classification(s) across the SureChEMBL global patent database.
Heterocyclic Building Blocks (14 patents)
Pharmaceutical Intermediates (5 patents)
Product Overview
Diethyl 2-[[4-(bromomethyl)benzoyl]amino]pentanedioate (CAS 70583-33-4), with molecular formula C17H22BrNO5 and molecular weight 399.06815 g/mol. IUPAC: diethyl 2-[[4-(bromomethyl)benzoyl]amino]pentanedioate.
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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