4-Iodo-3,5-dimethyl-1,2-oxazole
TL;DR: 4-Iodo-3,5-dimethyl-1,2-oxazole (CAS 60032-95-3) is a chemical compound with molecular formula C5H6INO and molecular weight 222.95 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
4-iodo-3,5-dimethyl-1,2-oxazole
Also Known As: 3,5-Dimethyl-4-iodoisoxazole, 4-Iodo-3,5-dimethylisoxazole, 4-iodo-3,5-dimethyl-1,2-oxazole, Isoxazole, 4-iodo-3,5-dimethyl-, 4-iodo-3,5-dimethyl-isoxazole
| Molecular Formula | C5H6INO |
|---|---|
| Molecular Weight | 222.95 g/mol |
| LogP | 1.8 |
| Topological Polar Surface Area | 26.0 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 2 |
| Rotatable Bonds | 0 |
| Exact Mass | 222.94942 |
| Heavy Atoms | 8 |
| Complexity | 88.0 |
Chemical Identifiers
| CAS Number | 60032-95-3 |
|---|---|
| SMILES | CC1=C(C(=NO1)C)I |
| InChIKey | NMNOXVWRJISEFE-UHFFFAOYSA-N |
Patent-Derived Application Labels
Derived from 4 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
4-Iodo-3,5-dimethyl-1,2-oxazole (CAS 60032-95-3), with molecular formula C5H6INO and molecular weight 222.95 g/mol. IUPAC: 4-iodo-3,5-dimethyl-1,2-oxazole.
Chemical Property Profile of 4-Iodo-3,5-dimethyl-1,2-oxazole
Property Insights of 4-Iodo-3,5-dimethyl-1,2-oxazole
The XLogP value of 1.8 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 4-Iodo-3,5-dimethyl-1,2-oxazole. With a topological polar surface area (TPSA) of 26.0 Ų, 4-Iodo-3,5-dimethyl-1,2-oxazole exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 4-Iodo-3,5-dimethyl-1,2-oxazole 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-Iodo-3,5-dimethyl-1,2-oxazole?
The CAS number of 4-Iodo-3,5-dimethyl-1,2-oxazole is 60032-95-3.
What is the molecular formula of 4-Iodo-3,5-dimethyl-1,2-oxazole?
The molecular formula of 4-Iodo-3,5-dimethyl-1,2-oxazole is C5H6INO.
What is the molecular weight of 4-Iodo-3,5-dimethyl-1,2-oxazole?
The molecular weight of 4-Iodo-3,5-dimethyl-1,2-oxazole is 222.95 g/mol.
Where can I buy 4-Iodo-3,5-dimethyl-1,2-oxazole?
You can request a quote for 4-Iodo-3,5-dimethyl-1,2-oxazole directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 4-Iodo-3,5-dimethyl-1,2-oxazole?
Yes, KEHONG BIO provides custom synthesis services for 4-Iodo-3,5-dimethyl-1,2-oxazole and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.