4-[Amino-(hydroxyamino)methylidene]-2,6-dihydroxy-1-cyclohexa-2,5-dienone structure

4-[Amino-(hydroxyamino)methylidene]-2,6-dihydroxy-1-cyclohexa-2,5-dienone

TL;DR: 4-[Amino-(hydroxyamino)methylidene]-2,6-dihydroxy-1-cyclohexa-2,5-dienone (CAS 95933-74-7) is a chemical compound with molecular formula C7H8N2O4 and molecular weight 184.05 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.

N',3,4,5-tetrahydroxybenzenecarboximidamide

Also Known As: Trimidox, 3,4,5-Trihydroxybenzamidoxime, N',3,4,5-tetrahydroxybenzamidine, n,3,4,5-tetrahydroxybenzimidamide, VF 233

CAS: 95933-74-7
Molecular Formula C7H8N2O4
Molecular Weight 184.05 g/mol
LogP 0.3
Topological Polar Surface Area 119.0 Ų
Hydrogen Bond Donors 5
Hydrogen Bond Acceptors 5
Rotatable Bonds 1
Exact Mass 184.0484
Heavy Atoms 13
Complexity 197.0

Chemical Identifiers

CAS Number 95933-74-7
SMILES C1=C(C=C(C(=C1O)O)O)C(=NO)N
InChIKey MSLJYSGFUMYUDX-UHFFFAOYSA-N

Patent-Derived Application Labels

Derived from 3 IPC patent classification(s) across the SureChEMBL global patent database.

Agrochemicals (1 patents) Organic Building Blocks (14 patents) Pharmaceutical Intermediates (67 patents)

Product Overview

4-[Amino-(hydroxyamino)methylidene]-2,6-dihydroxy-1-cyclohexa-2,5-dienone (CAS 95933-74-7), with molecular formula C7H8N2O4 and molecular weight 184.05 g/mol. IUPAC: N',3,4,5-tetrahydroxybenzenecarboximidamide.

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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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Chemical Property Profile of 4-[Amino-(hydroxyamino)methylidene]-2,6-dihydroxy-1-cyclohexa-2,5-dienone

XLogP
0.3
TPSA (Topological Polar Surface Area)
119.0
Hydrogen Bond Donors
5
Hydrogen Bond Acceptors
5
Rotatable Bonds
1
Heavy Atoms
13
Complexity
197.0
Exact Mass
184.0484
Monoisotopic Mass
184.0484
Data Source: Chemical property values are referenced from PubChem, the world's largest open chemistry database maintained by the National Center for Biotechnology Information (NCBI), U.S. National Library of Medicine.

Property Insights of 4-[Amino-(hydroxyamino)methylidene]-2,6-dihydroxy-1-cyclohexa-2,5-dienone

The XLogP value of 0.3 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 4-[Amino-(hydroxyamino)methylidene]-2,6-dihydroxy-1-cyclohexa-2,5-dienone. The TPSA of 119.0 Ų falls within the moderate polarity range, balancing permeability and solubility for 4-[Amino-(hydroxyamino)methylidene]-2,6-dihydroxy-1-cyclohexa-2,5-dienone. Following Lipinski's Rule of Five, 4-[Amino-(hydroxyamino)methylidene]-2,6-dihydroxy-1-cyclohexa-2,5-dienone has 5 hydrogen bond donor(s) and 5 hydrogen bond acceptor(s), all within the drug-like range, suggesting favorable oral bioavailability potential.

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?
Yes, we ship to most countries worldwide. Shipping costs and delivery times vary by location. Please contact us for specific shipping information.

Frequently Asked Questions

What is the CAS number of 4-[Amino-(hydroxyamino)methylidene]-2,6-dihydroxy-1-cyclohexa-2,5-dienone?

The CAS number of 4-[Amino-(hydroxyamino)methylidene]-2,6-dihydroxy-1-cyclohexa-2,5-dienone is 95933-74-7.

What is the molecular formula of 4-[Amino-(hydroxyamino)methylidene]-2,6-dihydroxy-1-cyclohexa-2,5-dienone?

The molecular formula of 4-[Amino-(hydroxyamino)methylidene]-2,6-dihydroxy-1-cyclohexa-2,5-dienone is C7H8N2O4.

What is the molecular weight of 4-[Amino-(hydroxyamino)methylidene]-2,6-dihydroxy-1-cyclohexa-2,5-dienone?

The molecular weight of 4-[Amino-(hydroxyamino)methylidene]-2,6-dihydroxy-1-cyclohexa-2,5-dienone is 184.05 g/mol.

Where can I buy 4-[Amino-(hydroxyamino)methylidene]-2,6-dihydroxy-1-cyclohexa-2,5-dienone?

You can request a quote for 4-[Amino-(hydroxyamino)methylidene]-2,6-dihydroxy-1-cyclohexa-2,5-dienone directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.

Does KEHONG BIO offer custom synthesis for 4-[Amino-(hydroxyamino)methylidene]-2,6-dihydroxy-1-cyclohexa-2,5-dienone?

Yes, KEHONG BIO provides custom synthesis services for 4-[Amino-(hydroxyamino)methylidene]-2,6-dihydroxy-1-cyclohexa-2,5-dienone and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.

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