berenil structure

berenil

2-acetamidoacetic acid;4-[2-(4-carbamimidoylphenyl)iminohydrazinyl]benzenecarboximidamide

CAS: 908-54-3
Molecular Formula C18H22N8O3
Molecular Weight 398.4 g/mol
Topological Polar Surface Area 203.0 A2
Hydrogen Bond Donors 7
Hydrogen Bond Acceptors 8
Rotatable Bonds 7
Exact Mass 398.1815
Heavy Atoms 29
Complexity 500.0

Chemical Identifiers

CAS Number 908-54-3
SMILES CC(=O)NCC(=O)O.C1=CC(=CC=C1C(=N)N)NN=NC2=CC=C(C=C2)C(=N)N
InChIKey XJLITJHUQRBWPN-UHFFFAOYSA-N

📖 Product Overview

berenil (CAS: 908-54-3) is a chemical compound with molecular formula C18H22N8O3 and molecular weight 398.4 g/mol. Its IUPAC systematic name is 2-acetamidoacetic acid;4-[2-(4-carbamimidoylphenyl)iminohydrazinyl]benzenecarboximidamide. Topological Polar Surface Area 203.0 A2 Hydrogen Bond Donors 7 Hydrogen Bond Acceptors 8 Rotatable Bonds 7 Exact Mass 398.1815 Heavy Atoms 29 Complexity 500.0 InChI Key: XJLITJHUQRBWPN-UHFFFAOYSA-N. SMILES: CC(=O)NCC(=O)O.C1=CC(=CC=C1C(=N)N)NN=NC2=CC=C(C=C2)C(=N)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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Frequently Asked Questions

What is the typical lead time for this product?
Lead time typically ranges from 3-7 business days for in-stock items. For larger quantities or custom orders, please contact us for specific lead times.
Can you provide samples for testing?
Yes, we offer sample quantities for quality testing. Please submit an inquiry with your requirements and we will arrange samples accordingly.
What documentation do you provide with the product?
We provide COA (Certificate of Analysis), MSDS (Material Safety Data Sheet), and technical data sheets with each shipment.
Do you ship internationally?
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