4-(氯甲基)-2,2-二甲基-1,3-二硫戊环
TL;DR: 4-(氯甲基)-2,2-二甲基-1,3-二硫戊环 (CAS 6008-74-8) is a chemical compound with molecular formula C6H11ClS2 and molecular weight 182.00 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
4-(氯甲基)-2,2-二甲基-1,3-二硫戊环
4-(chloromethyl)-2,2-dimethyl-1,3-dithiolane
Also Known As: 4-(Chloromethyl)-2,2-dimethyl-1,3-dithiolane, 4-19-00-00071 (Beilstein Handbook Reference), 1,3-DITHIOLANE, 4-(CHLOROMETHYL)-2,2-DIMETHYL-, 4-Chloromethyl-2,2-dimethyl-1,3-dithiolan, 4-chloromethyl-2,2-dimethyl-[1,3]dithiolane
| Molecular Formula | C6H11ClS2 |
|---|---|
| Molecular Weight | 182.00 g/mol |
| LogP | 2.7 |
| Topological Polar Surface Area | 50.6 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 2 |
| Rotatable Bonds | 1 |
| Exact Mass | 181.99907 |
| Heavy Atoms | 9 |
| Complexity | 103.0 |
Chemical Identifiers
| CAS Number | 6008-74-8 |
|---|---|
| SMILES | CC1(SCC(S1)CCl)C |
| InChIKey | SGFKSWJIHZQDSJ-UHFFFAOYSA-N |
Patent-Derived Application Labels
Derived from 2 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
4-(氯甲基)-2,2-二甲基-1,3-二硫戊环 (CAS 6008-74-8), with molecular formula C6H11ClS2 and molecular weight 182.00 g/mol. IUPAC: 4-(chloromethyl)-2,2-dimethyl-1,3-dithiolane.
Chemical Property Profile of 4-(氯甲基)-2,2-二甲基-1,3-二硫戊环
Property Insights of 4-(氯甲基)-2,2-二甲基-1,3-二硫戊环
The XLogP value of 2.7 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 4-(氯甲基)-2,2-二甲基-1,3-二硫戊环. With a topological polar surface area (TPSA) of 50.6 Ų, 4-(氯甲基)-2,2-二甲基-1,3-二硫戊环 exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 4-(氯甲基)-2,2-二甲基-1,3-二硫戊环 has 0 hydrogen bond donor(s) and 2 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 4-(氯甲基)-2,2-二甲基-1,3-二硫戊环?
The CAS number of 4-(氯甲基)-2,2-二甲基-1,3-二硫戊环 is 6008-74-8.
What is the molecular formula of 4-(氯甲基)-2,2-二甲基-1,3-二硫戊环?
The molecular formula of 4-(氯甲基)-2,2-二甲基-1,3-二硫戊环 is C6H11ClS2.
What is the molecular weight of 4-(氯甲基)-2,2-二甲基-1,3-二硫戊环?
The molecular weight of 4-(氯甲基)-2,2-二甲基-1,3-二硫戊环 is 182.00 g/mol.
Where can I buy 4-(氯甲基)-2,2-二甲基-1,3-二硫戊环?
You can request a quote for 4-(氯甲基)-2,2-二甲基-1,3-二硫戊环 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 4-(氯甲基)-2,2-二甲基-1,3-二硫戊环?
Yes, KEHONG BIO provides custom synthesis services for 4-(氯甲基)-2,2-二甲基-1,3-二硫戊环 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.