5-(Chloromethyl)-2-phenyl-1,3-oxathiolane
TL;DR: 5-(Chloromethyl)-2-phenyl-1,3-oxathiolane (CAS 81715-45-9) is a chemical compound with molecular formula C10H11ClOS and molecular weight 214.02 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
5-(chloromethyl)-2-phenyl-1,3-oxathiolane
Also Known As: 5-(chloromethyl)-2-phenyl-1,3-oxathiolane, RefChem:300340
| Molecular Formula | C10H11ClOS |
|---|---|
| Molecular Weight | 214.02 g/mol |
| LogP | 2.8 |
| Topological Polar Surface Area | 34.5 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 2 |
| Rotatable Bonds | 2 |
| Exact Mass | 214.02191 |
| Heavy Atoms | 13 |
| Complexity | 159.0 |
Chemical Identifiers
| CAS Number | 81715-45-9 |
|---|---|
| SMILES | C1C(OC(S1)C2=CC=CC=C2)CCl |
| InChIKey | CTDIIHZYJVLIFA-UHFFFAOYSA-N |
Product Overview
5-(Chloromethyl)-2-phenyl-1,3-oxathiolane (CAS 81715-45-9), with molecular formula C10H11ClOS and molecular weight 214.02 g/mol. IUPAC: 5-(chloromethyl)-2-phenyl-1,3-oxathiolane.
Chemical Property Profile of 5-(Chloromethyl)-2-phenyl-1,3-oxathiolane
Property Insights of 5-(Chloromethyl)-2-phenyl-1,3-oxathiolane
The XLogP value of 2.8 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 5-(Chloromethyl)-2-phenyl-1,3-oxathiolane. With a topological polar surface area (TPSA) of 34.5 Ų, 5-(Chloromethyl)-2-phenyl-1,3-oxathiolane exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 5-(Chloromethyl)-2-phenyl-1,3-oxathiolane 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 5-(Chloromethyl)-2-phenyl-1,3-oxathiolane?
The CAS number of 5-(Chloromethyl)-2-phenyl-1,3-oxathiolane is 81715-45-9.
What is the molecular formula of 5-(Chloromethyl)-2-phenyl-1,3-oxathiolane?
The molecular formula of 5-(Chloromethyl)-2-phenyl-1,3-oxathiolane is C10H11ClOS.
What is the molecular weight of 5-(Chloromethyl)-2-phenyl-1,3-oxathiolane?
The molecular weight of 5-(Chloromethyl)-2-phenyl-1,3-oxathiolane is 214.02 g/mol.
Where can I buy 5-(Chloromethyl)-2-phenyl-1,3-oxathiolane?
You can request a quote for 5-(Chloromethyl)-2-phenyl-1,3-oxathiolane directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 5-(Chloromethyl)-2-phenyl-1,3-oxathiolane?
Yes, KEHONG BIO provides custom synthesis services for 5-(Chloromethyl)-2-phenyl-1,3-oxathiolane and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.