diethyl (2S)-2-[(4-aminobenzoyl)amino]pentanedioate

CAS: 13726-52-8

Molecular Formula	`C16H22N2O5`
Molecular Weight	322.36 g/mol
LogP	1.4
Topological Polar Surface Area	108.0 A2
Hydrogen Bond Donors	2
Hydrogen Bond Acceptors	6
Rotatable Bonds	10
Exact Mass	322.15286
Heavy Atoms	23
Complexity	405.0

Chemical Identifiers

CAS Number	13726-52-8
SMILES	`CCOC(=O)CCC(C(=O)OCC)NC(=O)C1=CC=C(C=C1)N`
InChIKey	`RJXFBLRRPYBPTM-ZDUSSCGKSA-N`

📖 Product Overview

diethyl (2S)-2-[(4-aminobenzoyl)amino]pentanedioate (CAS: 13726-52-8) is a chemical compound with molecular formula C16H22N2O5 and molecular weight 322.36 g/mol. Its IUPAC systematic name is diethyl (2S)-2-[(4-aminobenzoyl)amino]pentanedioate. LogP 1.4 Topological Polar Surface Area 108.0 A2 Hydrogen Bond Donors 2 Hydrogen Bond Acceptors 6 Rotatable Bonds 10 Exact Mass 322.15286 Heavy Atoms 23 Complexity 405.0 InChI Key: RJXFBLRRPYBPTM-ZDUSSCGKSA-N. SMILES: CCOC(=O)CCC(C(=O)OCC)NC(=O)C1=CC=C(C=C1)N.

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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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