RefChem:117453
TL;DR: RefChem:117453 (CAS 3161-59-9) is a chemical compound with molecular formula C14H12Cl5N3OZn and molecular weight 476.87 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
zinc;2-chloro-5-(4-chlorophenoxy)-4-(dimethylamino)benzenediazonium;trichloride
Also Known As: 2-Chloro-5-(p-chlorophenoxy)-4-dimethylaminobenzenediazonium chloride, compound with zinc chloride, Benzenediazonium, 2-chloro-5-(4-chlorophenoxy)-4-(dimethylamino)-, trichlorozincate(1-), Benzenediazonium, 2-chloro-5-(4-chlorophenoxy)-4-(dimethylamino)-, trichlorozincate(1-) (1:1), zinc 2-chloro-5-(4-chlorophenoxy)-4-(dimethylamino)benzenediazonium trichloride, RefChem:117453
| Molecular Formula | C14H12Cl5N3OZn |
|---|---|
| Molecular Weight | 476.87 g/mol |
| LogP | -3.65422 |
| Topological Polar Surface Area | 40.62 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 3 |
| Exact Mass | 476.87143 |
| Heavy Atoms | 24 |
| Complexity | 677.3455 |
Chemical Identifiers
| CAS Number | 3161-59-9 |
|---|---|
| SMILES | CN(C)C1=C(C=C(C(=C1)Cl)[N+]#N)OC2=CC=C(C=C2)Cl.[Cl-].[Cl-].[Cl-].[Zn+2] |
Product Overview
RefChem:117453 (CAS 3161-59-9), with molecular formula C14H12Cl5N3OZn and molecular weight 476.87 g/mol. IUPAC: zinc;2-chloro-5-(4-chlorophenoxy)-4-(dimethylamino)benzenediazonium;trichloride.
Chemical Property Profile of RefChem:117453
Property Insights of RefChem:117453
The XLogP value of -3.65422 indicates that RefChem:117453 is hydrophilic (water-soluble), making it suitable for aqueous formulations and biological assay applications. With a topological polar surface area (TPSA) of 40.62 Ų, RefChem:117453 exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, RefChem:117453 has 0 hydrogen bond donor(s) and 3 hydrogen bond acceptor(s), all within the drug-like range, suggesting favorable oral bioavailability potential.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of RefChem:117453?
The CAS number of RefChem:117453 is 3161-59-9.
What is the molecular formula of RefChem:117453?
The molecular formula of RefChem:117453 is C14H12Cl5N3OZn.
What is the molecular weight of RefChem:117453?
The molecular weight of RefChem:117453 is 476.87 g/mol.
Where can I buy RefChem:117453?
You can request a quote for RefChem:117453 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for RefChem:117453?
Yes, KEHONG BIO provides custom synthesis services for RefChem:117453 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.