3-Isopropyl-5-(methoxymethyl)isoxazole
TL;DR: 3-Isopropyl-5-(methoxymethyl)isoxazole (CAS 392312-48-0) is a chemical compound with molecular formula C8H13NO2 and molecular weight 155.09 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
5-(methoxymethyl)-3-propan-2-yl-1,2-oxazole
Also Known As: Isoxazole,5- -3- -, 3-Isopropyl-5-(methoxymethyl)isoxazole, 5-(methoxymethyl)-3-propan-2-yl-1,2-oxazole, methoxy[3-(methylethyl)isoxazol-5-yl]methane, ISOXAZOLE, 5-(METHOXYMETHYL)-3-(1-METHYLETHYL)-
| Molecular Formula | C8H13NO2 |
|---|---|
| Molecular Weight | 155.09 g/mol |
| LogP | 1.9444 |
| Topological Polar Surface Area | 35.26 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 3 |
| Exact Mass | 155.09464 |
| Heavy Atoms | 11 |
| Complexity | 217.62157 |
Chemical Identifiers
| CAS Number | 392312-48-0 |
|---|---|
| SMILES | CC(C)C1=NOC(=C1)COC |
Product Overview
3-Isopropyl-5-(methoxymethyl)isoxazole (CAS 392312-48-0), with molecular formula C8H13NO2 and molecular weight 155.09 g/mol. IUPAC: 5-(methoxymethyl)-3-propan-2-yl-1,2-oxazole.
Chemical Property Profile of 3-Isopropyl-5-(methoxymethyl)isoxazole
Property Insights of 3-Isopropyl-5-(methoxymethyl)isoxazole
The XLogP value of 1.9444 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 3-Isopropyl-5-(methoxymethyl)isoxazole. With a topological polar surface area (TPSA) of 35.26 Ų, 3-Isopropyl-5-(methoxymethyl)isoxazole exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 3-Isopropyl-5-(methoxymethyl)isoxazole has 0 hydrogen bond donor(s) and 3 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-Isopropyl-5-(methoxymethyl)isoxazole?
The CAS number of 3-Isopropyl-5-(methoxymethyl)isoxazole is 392312-48-0.
What is the molecular formula of 3-Isopropyl-5-(methoxymethyl)isoxazole?
The molecular formula of 3-Isopropyl-5-(methoxymethyl)isoxazole is C8H13NO2.
What is the molecular weight of 3-Isopropyl-5-(methoxymethyl)isoxazole?
The molecular weight of 3-Isopropyl-5-(methoxymethyl)isoxazole is 155.09 g/mol.
Where can I buy 3-Isopropyl-5-(methoxymethyl)isoxazole?
You can request a quote for 3-Isopropyl-5-(methoxymethyl)isoxazole directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 3-Isopropyl-5-(methoxymethyl)isoxazole?
Yes, KEHONG BIO provides custom synthesis services for 3-Isopropyl-5-(methoxymethyl)isoxazole and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.