Chlorhexidine Acetate
TL;DR: Chlorhexidine Acetate (CAS 206986-79-0) 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;(1E)-2-[6-[[amino-[(E)-[amino-(4-chloroanilino)methylidene]amino]methylidene]amino]hexyl]-1-[amino-(4-chloroanilino)methylidene]guanidine
Also Known As: Chlorhexidine diacetate, Chlorhexidine acetate, Bactigras, Hibitane diacetate, Nolvasan
| Molecular Formula | C26H38Cl2N10O4 |
|---|---|
| Molecular Weight | 624.25 g/mol |
| LogP | 3.5184 |
| Topological Polar Surface Area | 252.18 Ų |
| Hydrogen Bond Donors | 8 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 9 |
| Exact Mass | 624.2455 |
| Heavy Atoms | 42 |
| Complexity | 1115.0957 |
Chemical Identifiers
| CAS Number | 206986-79-0 |
|---|---|
| SMILES | CC(=O)O.CC(=O)O.C1=CC(=CC=C1N/C(=N/C(=NCCCCCCN=C(/N=C(/NC2=CC=C(C=C2)Cl)\N)N)N)/N)Cl |
Product Overview
Chlorhexidine Acetate (CAS 206986-79-0), with molecular formula C26H38Cl2N10O4 and molecular weight 624.25 g/mol. IUPAC: acetic acid;(1E)-2-[6-[[amino-[(E)-[amino-(4-chloroanilino)methylidene]amino]methylidene]amino]hexyl]-1-[amino-(4-chloroanilino)methylidene]guanidine.
Chemical Property Profile of Chlorhexidine Acetate
Property Insights of Chlorhexidine Acetate
The XLogP value of 3.5184 indicates that Chlorhexidine Acetate is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 252.18 Ų indicates high polarity, suggesting Chlorhexidine Acetate may have limited membrane permeability but good aqueous solubility. Following Lipinski's Rule of Five, Chlorhexidine Acetate has 8 hydrogen bond donor(s) and 4 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of Chlorhexidine Acetate?
The CAS number of Chlorhexidine Acetate is 206986-79-0.
What is the molecular formula of Chlorhexidine Acetate?
The molecular formula of Chlorhexidine Acetate is C26H38Cl2N10O4.
What is the molecular weight of Chlorhexidine Acetate?
The molecular weight of Chlorhexidine Acetate is 624.25 g/mol.
Where can I buy Chlorhexidine Acetate?
You can request a quote for Chlorhexidine Acetate directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Chlorhexidine Acetate?
Yes, KEHONG BIO provides custom synthesis services for Chlorhexidine Acetate and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.