(2,3-Dichlorophenyl) 3,5-dimethyl-1,2-oxazole-4-carboxylate
TL;DR: (2,3-Dichlorophenyl) 3,5-dimethyl-1,2-oxazole-4-carboxylate (CAS 1002684-49-2) is a chemical compound with molecular formula C12H9Cl2NO3 and molecular weight 285.00 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
(2,3-dichlorophenyl) 3,5-dimethyl-1,2-oxazole-4-carboxylate
Also Known As: (2,3-dichlorophenyl) 3,5-dimethyl-1,2-oxazole-4-carboxylate, 4-Isoxazolecarboxylic acid, 3,5-dimethyl-, 2,3-dichlorophenyl ester
| Molecular Formula | C12H9Cl2NO3 |
|---|---|
| Molecular Weight | 285.00 g/mol |
| LogP | 3.81744 |
| Topological Polar Surface Area | 52.33 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 2 |
| Exact Mass | 284.99594 |
| Heavy Atoms | 18 |
| Complexity | 587.8652 |
Chemical Identifiers
| CAS Number | 1002684-49-2 |
|---|---|
| SMILES | CC1=C(C(=NO1)C)C(=O)OC2=C(C(=CC=C2)Cl)Cl |
Product Overview
(2,3-Dichlorophenyl) 3,5-dimethyl-1,2-oxazole-4-carboxylate (CAS 1002684-49-2), with molecular formula C12H9Cl2NO3 and molecular weight 285.00 g/mol. IUPAC: (2,3-dichlorophenyl) 3,5-dimethyl-1,2-oxazole-4-carboxylate.
Chemical Property Profile of (2,3-Dichlorophenyl) 3,5-dimethyl-1,2-oxazole-4-carboxylate
Property Insights of (2,3-Dichlorophenyl) 3,5-dimethyl-1,2-oxazole-4-carboxylate
The XLogP value of 3.81744 indicates that (2,3-Dichlorophenyl) 3,5-dimethyl-1,2-oxazole-4-carboxylate is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 52.33 Ų, (2,3-Dichlorophenyl) 3,5-dimethyl-1,2-oxazole-4-carboxylate exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, (2,3-Dichlorophenyl) 3,5-dimethyl-1,2-oxazole-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
Frequently Asked Questions
What is the CAS number of (2,3-Dichlorophenyl) 3,5-dimethyl-1,2-oxazole-4-carboxylate?
The CAS number of (2,3-Dichlorophenyl) 3,5-dimethyl-1,2-oxazole-4-carboxylate is 1002684-49-2.
What is the molecular formula of (2,3-Dichlorophenyl) 3,5-dimethyl-1,2-oxazole-4-carboxylate?
The molecular formula of (2,3-Dichlorophenyl) 3,5-dimethyl-1,2-oxazole-4-carboxylate is C12H9Cl2NO3.
What is the molecular weight of (2,3-Dichlorophenyl) 3,5-dimethyl-1,2-oxazole-4-carboxylate?
The molecular weight of (2,3-Dichlorophenyl) 3,5-dimethyl-1,2-oxazole-4-carboxylate is 285.00 g/mol.
Where can I buy (2,3-Dichlorophenyl) 3,5-dimethyl-1,2-oxazole-4-carboxylate?
You can request a quote for (2,3-Dichlorophenyl) 3,5-dimethyl-1,2-oxazole-4-carboxylate directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for (2,3-Dichlorophenyl) 3,5-dimethyl-1,2-oxazole-4-carboxylate?
Yes, KEHONG BIO provides custom synthesis services for (2,3-Dichlorophenyl) 3,5-dimethyl-1,2-oxazole-4-carboxylate and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.