Chlorhexidine diacetate 100 microg/mL in Acetonitrile:Water structure

Chlorhexidine diacetate 100 microg/mL in Acetonitrile:Water

TL;DR: Chlorhexidine diacetate 100 microg/mL in Acetonitrile:Water (CAS 56-95-1) is a chemical compound with molecular formula C26H38Cl2N10O4 and molecular weight 624.25 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.

acetic acid;2-[6-[[amino-[[amino-(4-chloroanilino)methylidene]amino]methylidene]amino]hexyl]-1-[amino-(4-chloroanilino)methylidene]guanidine

Also Known As: Chlorhexidine diacetate, Chlorhexidine acetate, chlorzoin, Chlorhexidine diacetate CRS, Chlorhexidine Gluconate 20%

CAS: 56-95-1
Molecular Formula C26H38Cl2N10O4
Molecular Weight 624.25 g/mol
LogP 3.52
Topological Polar Surface Area 252.0 Ų
Hydrogen Bond Donors 8
Hydrogen Bond Acceptors 6
Rotatable Bonds 13
Exact Mass 624.2455
Heavy Atoms 42
Complexity 679.0

Chemical Identifiers

CAS Number 56-95-1
SMILES CC(=O)O.CC(=O)O.C1=CC(=CC=C1NC(=NC(=NCCCCCCN=C(N)N=C(N)NC2=CC=C(C=C2)Cl)N)N)Cl
InChIKey WDRFFJWBUDTUCA-UHFFFAOYSA-N

Patent-Derived Application Labels

Derived from 18 IPC patent classification(s) across the SureChEMBL global patent database.

Agrochemicals (321 patents) Analytical Reagents (79 patents) Biotechnology (192 patents) Catalysts (11 patents) Coatings & Adhesives (39 patents) +13 more

Product Overview

Chlorhexidine diacetate 100 microg/mL in Acetonitrile:Water (CAS 56-95-1), with molecular formula C26H38Cl2N10O4 and molecular weight 624.25 g/mol. IUPAC: acetic acid;2-[6-[[amino-[[amino-(4-chloroanilino)methylidene]amino]methylidene]amino]hexyl]-1-[amino-(4-chloroanilino)methylidene]guanidine.

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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.
View MSDS →

Chemical Property Profile of Chlorhexidine diacetate 100 microg/mL in Acetonitrile:Water

XLogP
3.52
TPSA (Topological Polar Surface Area)
252.0
Hydrogen Bond Donors
8
Hydrogen Bond Acceptors
6
Rotatable Bonds
13
Heavy Atoms
42
Complexity
679.0
Exact Mass
624.2455
Monoisotopic Mass
624.2455
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 Chlorhexidine diacetate 100 microg/mL in Acetonitrile:Water

The XLogP value of 3.52 indicates that Chlorhexidine diacetate 100 microg/mL in Acetonitrile:Water is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 252.0 Ų indicates high polarity, suggesting Chlorhexidine diacetate 100 microg/mL in Acetonitrile:Water may have limited membrane permeability but good aqueous solubility. Following Lipinski's Rule of Five, Chlorhexidine diacetate 100 microg/mL in Acetonitrile:Water has 8 hydrogen bond donor(s) and 6 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.

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 Chlorhexidine diacetate 100 microg/mL in Acetonitrile:Water?

The CAS number of Chlorhexidine diacetate 100 microg/mL in Acetonitrile:Water is 56-95-1.

What is the molecular formula of Chlorhexidine diacetate 100 microg/mL in Acetonitrile:Water?

The molecular formula of Chlorhexidine diacetate 100 microg/mL in Acetonitrile:Water is C26H38Cl2N10O4.

What is the molecular weight of Chlorhexidine diacetate 100 microg/mL in Acetonitrile:Water?

The molecular weight of Chlorhexidine diacetate 100 microg/mL in Acetonitrile:Water is 624.25 g/mol.

Where can I buy Chlorhexidine diacetate 100 microg/mL in Acetonitrile:Water?

You can request a quote for Chlorhexidine diacetate 100 microg/mL in Acetonitrile:Water directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.

Does KEHONG BIO offer custom synthesis for Chlorhexidine diacetate 100 microg/mL in Acetonitrile:Water?

Yes, KEHONG BIO provides custom synthesis services for Chlorhexidine diacetate 100 microg/mL in Acetonitrile:Water and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.

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