3-(Chloromethyl)-3-methyloxetane
TL;DR: 3-(Chloromethyl)-3-methyloxetane (CAS 822-48-0) is a chemical compound with molecular formula C5H9ClO and molecular weight 120.03 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
3-(chloromethyl)-3-methyloxetane
Also Known As: 3-(Chloromethyl)-3-methyloxetane, 3-Chloromethyl-3-methyloxetane, 2-(Chloromethyl)-2-methyl-1,3-epoxypropane, Oxetane, 3-(chloromethyl)-3-methyl-, 3-Chloromethyl-3-methyloxacyclobutane
| Molecular Formula | C5H9ClO |
|---|---|
| Molecular Weight | 120.03 g/mol |
| LogP | 1.1 |
| Topological Polar Surface Area | 9.2 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 1 |
| Rotatable Bonds | 1 |
| Exact Mass | 120.034195 |
| Heavy Atoms | 7 |
| Complexity | 68.0 |
Chemical Identifiers
| CAS Number | 822-48-0 |
|---|---|
| SMILES | CC1(COC1)CCl |
| InChIKey | MCZYEFODKAZWIH-UHFFFAOYSA-N |
Patent-Derived Application Labels
Derived from 9 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
3-(Chloromethyl)-3-methyloxetane (CAS 822-48-0), with molecular formula C5H9ClO and molecular weight 120.03 g/mol. IUPAC: 3-(chloromethyl)-3-methyloxetane.
Chemical Property Profile of 3-(Chloromethyl)-3-methyloxetane
Property Insights of 3-(Chloromethyl)-3-methyloxetane
The XLogP value of 1.1 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 3-(Chloromethyl)-3-methyloxetane. With a topological polar surface area (TPSA) of 9.2 Ų, 3-(Chloromethyl)-3-methyloxetane exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 3-(Chloromethyl)-3-methyloxetane has 0 hydrogen bond donor(s) and 1 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 3-(Chloromethyl)-3-methyloxetane?
The CAS number of 3-(Chloromethyl)-3-methyloxetane is 822-48-0.
What is the molecular formula of 3-(Chloromethyl)-3-methyloxetane?
The molecular formula of 3-(Chloromethyl)-3-methyloxetane is C5H9ClO.
What is the molecular weight of 3-(Chloromethyl)-3-methyloxetane?
The molecular weight of 3-(Chloromethyl)-3-methyloxetane is 120.03 g/mol.
Where can I buy 3-(Chloromethyl)-3-methyloxetane?
You can request a quote for 3-(Chloromethyl)-3-methyloxetane directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 3-(Chloromethyl)-3-methyloxetane?
Yes, KEHONG BIO provides custom synthesis services for 3-(Chloromethyl)-3-methyloxetane and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.