RefChem:117515
TL;DR: RefChem:117515 (CAS 68400-18-0) is a chemical compound with molecular formula C28H42Cl4N4O4S2Zn and molecular weight 766.07 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
zinc;bis(4-butylsulfanyl-2,5-diethoxybenzenediazonium);tetrachloride
Also Known As: Benzenediazonium, 4-(butylthio)-2,5-diethoxy-, (T-4)-tetrachlorozincate(2-) (2:1), p-(1-Butylmercapto)-2,5-diethoxybenzenediazonium chloride zinc chloride, 4-(butylsulfanyl)-2,5-diethoxybenzenediazonium zinc chloride(2:1:4), zinc 4-butylsulfanyl-2,5-diethoxybenzenediazonium tetrachloride, 4-(Butylsulfanyl)-2,5-diethoxybenzene-1-diazonium zinc chloride (2/1/4)
| Molecular Formula | C28H42Cl4N4O4S2Zn |
|---|---|
| Molecular Weight | 766.07 g/mol |
| LogP | -2.26 |
| Topological Polar Surface Area | 144.0 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 12 |
| Rotatable Bonds | 16 |
| Exact Mass | 768.06635 |
| Heavy Atoms | 43 |
| Complexity | 292.0 |
Chemical Identifiers
| CAS Number | 68400-18-0 |
|---|---|
| SMILES | CCCCSC1=C(C=C(C(=C1)OCC)[N+]#N)OCC.CCCCSC1=C(C=C(C(=C1)OCC)[N+]#N)OCC.[Cl-].[Cl-].[Cl-].[Cl-].[Zn+2] |
| InChIKey | NNHOIXLAZVJTOY-UHFFFAOYSA-J |
Product Overview
RefChem:117515 (CAS 68400-18-0), with molecular formula C28H42Cl4N4O4S2Zn and molecular weight 766.07 g/mol. IUPAC: zinc;bis(4-butylsulfanyl-2,5-diethoxybenzenediazonium);tetrachloride.
Chemical Property Profile of RefChem:117515
Property Insights of RefChem:117515
The XLogP value of -2.26 indicates that RefChem:117515 is hydrophilic (water-soluble), making it suitable for aqueous formulations and biological assay applications. The TPSA of 144.0 Ų indicates high polarity, suggesting RefChem:117515 may have limited membrane permeability but good aqueous solubility. Following Lipinski's Rule of Five, RefChem:117515 has 0 hydrogen bond donor(s) and 12 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of RefChem:117515?
The CAS number of RefChem:117515 is 68400-18-0.
What is the molecular formula of RefChem:117515?
The molecular formula of RefChem:117515 is C28H42Cl4N4O4S2Zn.
What is the molecular weight of RefChem:117515?
The molecular weight of RefChem:117515 is 766.07 g/mol.
Where can I buy RefChem:117515?
You can request a quote for RefChem:117515 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for RefChem:117515?
Yes, KEHONG BIO provides custom synthesis services for RefChem:117515 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.