But-2-enedioic acid;piperazine structure

But-2-enedioic acid;piperazine

but-2-enedioic acid;piperazine

Also Known As: but-2-enedioic acid; piperazine|piperazine but-2-enedioate(1:1)

CAS: 4598-64-5
Molecular Formula C8H14N2O4
Molecular Weight 202.09535 g/mol
LogP -1.109
Topological Polar Surface Area 98.7 Ų
Hydrogen Bond Donors 4
Hydrogen Bond Acceptors 6
Rotatable Bonds 2
Exact Mass 202.09535
Monoisotopic Mass 202.09535
Heavy Atoms 14
Complexity 146.0

Chemical Identifiers

CAS Number 4598-64-5
SMILES C1CNCCN1.C(=CC(=O)O)C(=O)O
InChIKey LCXSXBYYVYTYDY-UHFFFAOYSA-N

Patent-Derived Application Labels

Derived from 2 IPC patent classification(s) across the SureChEMBL global patent database.

Heterocyclic Building Blocks (61 patents) Pharmaceutical Intermediates (23 patents)

Product Overview

But-2-enedioic acid;piperazine (CAS 4598-64-5), with molecular formula C8H14N2O4 and molecular weight 202.09535 g/mol. IUPAC: but-2-enedioic acid;piperazine.

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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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