2-Chloro-5,6-dimethoxy-3-(tetradecylsulfanyl)cyclohexa-2,5-diene-1,4-dione
TL;DR: 2-Chloro-5,6-dimethoxy-3-(tetradecylsulfanyl)cyclohexa-2,5-diene-1,4-dione (CAS 69241-89-0) is a chemical compound with molecular formula C22H35ClO4S and molecular weight 430.19 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2-chloro-5,6-dimethoxy-3-tetradecylsulfanylcyclohexa-2,5-diene-1,4-dione
Also Known As: 2,4-dione, 2-chloro-5,6-dimethoxy-3-(tetradecylthio)-, 2-Chloro-5,6-dimethoxy-3-(tetradecylsulfanyl)cyclohexa-2,5-diene-1,4-dione, 2-chloro-5,6-dimethoxy-3-tetradecylsulfanylcyclohexa-2,5-die, 2-chloro-5,6-dimethoxy-3-tetradecylsulfanyl-cyclohexa-2,5-diene-1,4-dione, 2-chloro-5,6-dimethoxy-3-tetradecylsulfanylcyclohexa-2,5-diene-1,4-dione
| Molecular Formula | C22H35ClO4S |
|---|---|
| Molecular Weight | 430.19 g/mol |
| LogP | 8.6 |
| Topological Polar Surface Area | 77.9 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 16 |
| Exact Mass | 430.19446 |
| Heavy Atoms | 28 |
| Complexity | 569.0 |
Chemical Identifiers
| CAS Number | 69241-89-0 |
|---|---|
| SMILES | CCCCCCCCCCCCCCSC1=C(C(=O)C(=C(C1=O)OC)OC)Cl |
| InChIKey | BHMRBEIQYOQBFU-UHFFFAOYSA-N |
Product Overview
2-Chloro-5,6-dimethoxy-3-(tetradecylsulfanyl)cyclohexa-2,5-diene-1,4-dione (CAS 69241-89-0), with molecular formula C22H35ClO4S and molecular weight 430.19 g/mol. IUPAC: 2-chloro-5,6-dimethoxy-3-tetradecylsulfanylcyclohexa-2,5-diene-1,4-dione.
Chemical Property Profile of 2-Chloro-5,6-dimethoxy-3-(tetradecylsulfanyl)cyclohexa-2,5-diene-1,4-dione
Property Insights of 2-Chloro-5,6-dimethoxy-3-(tetradecylsulfanyl)cyclohexa-2,5-diene-1,4-dione
The XLogP value of 8.6 indicates that 2-Chloro-5,6-dimethoxy-3-(tetradecylsulfanyl)cyclohexa-2,5-diene-1,4-dione is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 77.9 Ų falls within the moderate polarity range, balancing permeability and solubility for 2-Chloro-5,6-dimethoxy-3-(tetradecylsulfanyl)cyclohexa-2,5-diene-1,4-dione. Following Lipinski's Rule of Five, 2-Chloro-5,6-dimethoxy-3-(tetradecylsulfanyl)cyclohexa-2,5-diene-1,4-dione has 0 hydrogen bond donor(s) and 5 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of 2-Chloro-5,6-dimethoxy-3-(tetradecylsulfanyl)cyclohexa-2,5-diene-1,4-dione?
The CAS number of 2-Chloro-5,6-dimethoxy-3-(tetradecylsulfanyl)cyclohexa-2,5-diene-1,4-dione is 69241-89-0.
What is the molecular formula of 2-Chloro-5,6-dimethoxy-3-(tetradecylsulfanyl)cyclohexa-2,5-diene-1,4-dione?
The molecular formula of 2-Chloro-5,6-dimethoxy-3-(tetradecylsulfanyl)cyclohexa-2,5-diene-1,4-dione is C22H35ClO4S.
What is the molecular weight of 2-Chloro-5,6-dimethoxy-3-(tetradecylsulfanyl)cyclohexa-2,5-diene-1,4-dione?
The molecular weight of 2-Chloro-5,6-dimethoxy-3-(tetradecylsulfanyl)cyclohexa-2,5-diene-1,4-dione is 430.19 g/mol.
Where can I buy 2-Chloro-5,6-dimethoxy-3-(tetradecylsulfanyl)cyclohexa-2,5-diene-1,4-dione?
You can request a quote for 2-Chloro-5,6-dimethoxy-3-(tetradecylsulfanyl)cyclohexa-2,5-diene-1,4-dione directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 2-Chloro-5,6-dimethoxy-3-(tetradecylsulfanyl)cyclohexa-2,5-diene-1,4-dione?
Yes, KEHONG BIO provides custom synthesis services for 2-Chloro-5,6-dimethoxy-3-(tetradecylsulfanyl)cyclohexa-2,5-diene-1,4-dione and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.