Ethyl 4-(2-n-butylaminoacetylamino)benzoate hydrochloride structure

Ethyl 4-(2-n-butylaminoacetylamino)benzoate hydrochloride

butyl-[1-(4-ethoxycarbonylanilino)-1-oxopropan-2-yl]azanium chloride

CAS: 97555-45-8
Molecular Formula C16H25ClN2O3
Molecular Weight 328.83 g/mol
Topological Polar Surface Area 72.0 A2
Hydrogen Bond Donors 2
Hydrogen Bond Acceptors 4
Rotatable Bonds 9
Exact Mass 328.15536
Heavy Atoms 22
Complexity 325.0

Chemical Identifiers

CAS Number 97555-45-8
SMILES CCCC[NH2+]C(C)C(=O)NC1=CC=C(C=C1)C(=O)OCC.[Cl-]
InChIKey VKLYBWGNFDJEGX-UHFFFAOYSA-N

📖 Product Overview

Ethyl 4-(2-n-butylaminoacetylamino)benzoate hydrochloride (CAS: 97555-45-8) is a chemical compound with molecular formula C16H25ClN2O3 and molecular weight 328.83 g/mol. Its IUPAC systematic name is butyl-[1-(4-ethoxycarbonylanilino)-1-oxopropan-2-yl]azanium chloride. Topological Polar Surface Area 72.0 A2 Hydrogen Bond Donors 2 Hydrogen Bond Acceptors 4 Rotatable Bonds 9 Exact Mass 328.15536 Heavy Atoms 22 Complexity 325.0 InChI Key: VKLYBWGNFDJEGX-UHFFFAOYSA-N. SMILES: CCCC[NH2+]C(C)C(=O)NC1=CC=C(C=C1)C(=O)OCC.[Cl-].

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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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