2,2-二甲基-1,3-氧硫戊环
TL;DR: 2,2-二甲基-1,3-氧硫戊环 (CAS 5684-31-1) is a chemical compound with molecular formula C5H10OS and molecular weight 118.05 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2,2-二甲基-1,3-氧硫戊环
2,2-dimethyl-1,3-oxathiolane
Also Known As: 2,2-Dimethyl-1,3-oxathiolane, 2,3-oxathiolane, 1, 2,2-dimethyl-, 1,3-OXATHIOLANE, 2,2-DIMETHYL-, CC1(C)OCCS1
| Molecular Formula | C5H10OS |
|---|---|
| Molecular Weight | 118.05 g/mol |
| LogP | 1.2 |
| Topological Polar Surface Area | 34.5 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 2 |
| Rotatable Bonds | 0 |
| Exact Mass | 118.045235 |
| Heavy Atoms | 7 |
| Complexity | 70.0 |
Chemical Identifiers
| CAS Number | 5684-31-1 |
|---|---|
| SMILES | CC1(OCCS1)C |
| InChIKey | XLSCZCCJPDTCGU-UHFFFAOYSA-N |
Patent-Derived Application Labels
Derived from 5 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
2,2-二甲基-1,3-氧硫戊环 (CAS 5684-31-1), with molecular formula C5H10OS and molecular weight 118.05 g/mol. IUPAC: 2,2-dimethyl-1,3-oxathiolane.
Chemical Property Profile of 2,2-二甲基-1,3-氧硫戊环
Property Insights of 2,2-二甲基-1,3-氧硫戊环
The XLogP value of 1.2 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 2,2-二甲基-1,3-氧硫戊环. With a topological polar surface area (TPSA) of 34.5 Ų, 2,2-二甲基-1,3-氧硫戊环 exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 2,2-二甲基-1,3-氧硫戊环 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 2,2-二甲基-1,3-氧硫戊环?
The CAS number of 2,2-二甲基-1,3-氧硫戊环 is 5684-31-1.
What is the molecular formula of 2,2-二甲基-1,3-氧硫戊环?
The molecular formula of 2,2-二甲基-1,3-氧硫戊环 is C5H10OS.
What is the molecular weight of 2,2-二甲基-1,3-氧硫戊环?
The molecular weight of 2,2-二甲基-1,3-氧硫戊环 is 118.05 g/mol.
Where can I buy 2,2-二甲基-1,3-氧硫戊环?
You can request a quote for 2,2-二甲基-1,3-氧硫戊环 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 2,2-二甲基-1,3-氧硫戊环?
Yes, KEHONG BIO provides custom synthesis services for 2,2-二甲基-1,3-氧硫戊环 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.