Methyl 3-(2,6-dichlorophenyl)-5-methylisoxazole-4-carboxylate
TL;DR: Methyl 3-(2,6-dichlorophenyl)-5-methylisoxazole-4-carboxylate (CAS 1391052-23-5) is a chemical compound with molecular formula C12H9Cl2NO3 and molecular weight 284.99594 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
methyl 3-(2,6-dichlorophenyl)-5-methyl-1,2-oxazole-4-carboxylate
Also Known As: Methyl 3-(2,6-dichlorophenyl)-5-methylisoxazole-4-carboxylate, Maybridge1_008900, methyl 3-(2,6-dichlorophenyl)-5-methyl-1,2-oxazole-4-carboxylate, SALOR-INT L322032-1EA, 3698AE
Technical Specifications
| Molecular Formula | C12H9Cl2NO3 |
| Molecular Weight | 284.99594 g/mol |
| XLogP | 3.5 |
| Topological Polar Surface Area (TPSA) | 52.3 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 3 |
| Exact Mass | 284.99594 Da |
| Heavy Atoms | 18 |
| Complexity | 306.0 |
| SMILES | CC1=C(C(=NO1)C2=C(C=CC=C2Cl)Cl)C(=O)OC |
| InChIKey | YPCASVCAZYPZOI-UHFFFAOYSA-N |
Chemical Property Profile of Methyl 3-(2,6-dichlorophenyl)-5-methylisoxazole-4-carboxylate
Property Insights of Methyl 3-(2,6-dichlorophenyl)-5-methylisoxazole-4-carboxylate
The XLogP value of 3.5 indicates that Methyl 3-(2,6-dichlorophenyl)-5-methylisoxazole-4-carboxylate is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 52.3 Ų, Methyl 3-(2,6-dichlorophenyl)-5-methylisoxazole-4-carboxylate exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, Methyl 3-(2,6-dichlorophenyl)-5-methylisoxazole-4-carboxylate has 0 hydrogen bond donor(s) and 4 hydrogen bond acceptor(s), all within the drug-like range, suggesting favorable oral bioavailability potential.
Frequently Asked Questions
What is the CAS number of Methyl 3-(2,6-dichlorophenyl)-5-methylisoxazole-4-carboxylate?
The CAS number of Methyl 3-(2,6-dichlorophenyl)-5-methylisoxazole-4-carboxylate is 1391052-23-5.
What is the molecular formula of Methyl 3-(2,6-dichlorophenyl)-5-methylisoxazole-4-carboxylate?
The molecular formula of Methyl 3-(2,6-dichlorophenyl)-5-methylisoxazole-4-carboxylate is C12H9Cl2NO3.
What is the molecular weight of Methyl 3-(2,6-dichlorophenyl)-5-methylisoxazole-4-carboxylate?
The molecular weight of Methyl 3-(2,6-dichlorophenyl)-5-methylisoxazole-4-carboxylate is 284.99594 g/mol.
Where can I buy Methyl 3-(2,6-dichlorophenyl)-5-methylisoxazole-4-carboxylate?
You can request a quote for Methyl 3-(2,6-dichlorophenyl)-5-methylisoxazole-4-carboxylate directly from CoreyChem. Contact us or email [email protected] for pricing and availability.
Does CoreyChem offer custom synthesis for Methyl 3-(2,6-dichlorophenyl)-5-methylisoxazole-4-carboxylate?
Yes, CoreyChem provides custom synthesis services for Methyl 3-(2,6-dichlorophenyl)-5-methylisoxazole-4-carboxylate and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.