Methyl 3-Methyl-5-(5-methylisoxazol-3-yl)isoxazole-4-carboxylate
TL;DR: Methyl 3-Methyl-5-(5-methylisoxazol-3-yl)isoxazole-4-carboxylate (CAS 175277-12-0) is a chemical compound with molecular formula C10H10N2O4 and molecular weight 222.06 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
methyl 3-methyl-5-(5-methyl-1,2-oxazol-3-yl)-1,2-oxazole-4-carboxylate
Also Known As: Maybridge1_008803, Methyl 3-Methyl-5-(5-methylisoxazol-3-yl)isoxazole-4-carboxylate, 2-METHYLUNDECANOICACID, Methyl 3',5-dimethyl-[3,5'-biisoxazole]-4'-carboxylate, 5814AD
| Molecular Formula | C10H10N2O4 |
|---|---|
| Molecular Weight | 222.06 g/mol |
| LogP | 1.2 |
| Topological Polar Surface Area | 78.4 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 6 |
| Rotatable Bonds | 3 |
| Exact Mass | 222.06406 |
| Heavy Atoms | 16 |
| Complexity | 274.0 |
Chemical Identifiers
| CAS Number | 175277-12-0 |
|---|---|
| SMILES | CC1=CC(=NO1)C2=C(C(=NO2)C)C(=O)OC |
| InChIKey | FDSIFWDGJSJXMP-UHFFFAOYSA-N |
Product Overview
Methyl 3-Methyl-5-(5-methylisoxazol-3-yl)isoxazole-4-carboxylate (CAS 175277-12-0), with molecular formula C10H10N2O4 and molecular weight 222.06 g/mol. IUPAC: methyl 3-methyl-5-(5-methyl-1,2-oxazol-3-yl)-1,2-oxazole-4-carboxylate.
Chemical Property Profile of Methyl 3-Methyl-5-(5-methylisoxazol-3-yl)isoxazole-4-carboxylate
Property Insights of Methyl 3-Methyl-5-(5-methylisoxazol-3-yl)isoxazole-4-carboxylate
The XLogP value of 1.2 suggests moderate lipophilicity, balancing water solubility and membrane permeability for Methyl 3-Methyl-5-(5-methylisoxazol-3-yl)isoxazole-4-carboxylate. The TPSA of 78.4 Ų falls within the moderate polarity range, balancing permeability and solubility for Methyl 3-Methyl-5-(5-methylisoxazol-3-yl)isoxazole-4-carboxylate. Following Lipinski's Rule of Five, Methyl 3-Methyl-5-(5-methylisoxazol-3-yl)isoxazole-4-carboxylate has 0 hydrogen bond donor(s) and 6 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 Methyl 3-Methyl-5-(5-methylisoxazol-3-yl)isoxazole-4-carboxylate?
The CAS number of Methyl 3-Methyl-5-(5-methylisoxazol-3-yl)isoxazole-4-carboxylate is 175277-12-0.
What is the molecular formula of Methyl 3-Methyl-5-(5-methylisoxazol-3-yl)isoxazole-4-carboxylate?
The molecular formula of Methyl 3-Methyl-5-(5-methylisoxazol-3-yl)isoxazole-4-carboxylate is C10H10N2O4.
What is the molecular weight of Methyl 3-Methyl-5-(5-methylisoxazol-3-yl)isoxazole-4-carboxylate?
The molecular weight of Methyl 3-Methyl-5-(5-methylisoxazol-3-yl)isoxazole-4-carboxylate is 222.06 g/mol.
Where can I buy Methyl 3-Methyl-5-(5-methylisoxazol-3-yl)isoxazole-4-carboxylate?
You can request a quote for Methyl 3-Methyl-5-(5-methylisoxazol-3-yl)isoxazole-4-carboxylate directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Methyl 3-Methyl-5-(5-methylisoxazol-3-yl)isoxazole-4-carboxylate?
Yes, KEHONG BIO provides custom synthesis services for Methyl 3-Methyl-5-(5-methylisoxazol-3-yl)isoxazole-4-carboxylate and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.