Diethyl 2-[[4-(bromomethyl)benzoyl]amino]pentanedioate structure

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.

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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.
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