2-(4-Chlorophenyl)-5,5-dimethyl-4,5-dihydrooxazole
TL;DR: 2-(4-Chlorophenyl)-5,5-dimethyl-4,5-dihydrooxazole (CAS 33561-49-8) is a chemical compound with molecular formula C11H12ClNO and molecular weight 209.06 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2-(4-chlorophenyl)-5,5-dimethyl-4H-1,3-oxazole
Also Known As: 2-(4-chlorophenyl)-5,5-dimethyl-4H-1,3-oxazole, 2-(4-CHLOROPHENYL)-5,5-DIMETHYL-4,5-DIHYDROOXAZOLE
| Molecular Formula | C11H12ClNO |
|---|---|
| Molecular Weight | 209.06 g/mol |
| LogP | 2.8954 |
| Topological Polar Surface Area | 21.59 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 2 |
| Rotatable Bonds | 1 |
| Exact Mass | 209.06075 |
| Heavy Atoms | 14 |
| Complexity | 367.37885 |
Chemical Identifiers
| CAS Number | 33561-49-8 |
|---|---|
| SMILES | CC1(CN=C(O1)C2=CC=C(C=C2)Cl)C |
Product Overview
2-(4-Chlorophenyl)-5,5-dimethyl-4,5-dihydrooxazole (CAS 33561-49-8), with molecular formula C11H12ClNO and molecular weight 209.06 g/mol. IUPAC: 2-(4-chlorophenyl)-5,5-dimethyl-4H-1,3-oxazole.
Chemical Property Profile of 2-(4-Chlorophenyl)-5,5-dimethyl-4,5-dihydrooxazole
Property Insights of 2-(4-Chlorophenyl)-5,5-dimethyl-4,5-dihydrooxazole
The XLogP value of 2.8954 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 2-(4-Chlorophenyl)-5,5-dimethyl-4,5-dihydrooxazole. With a topological polar surface area (TPSA) of 21.59 Ų, 2-(4-Chlorophenyl)-5,5-dimethyl-4,5-dihydrooxazole exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 2-(4-Chlorophenyl)-5,5-dimethyl-4,5-dihydrooxazole 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 2-(4-Chlorophenyl)-5,5-dimethyl-4,5-dihydrooxazole?
The CAS number of 2-(4-Chlorophenyl)-5,5-dimethyl-4,5-dihydrooxazole is 33561-49-8.
What is the molecular formula of 2-(4-Chlorophenyl)-5,5-dimethyl-4,5-dihydrooxazole?
The molecular formula of 2-(4-Chlorophenyl)-5,5-dimethyl-4,5-dihydrooxazole is C11H12ClNO.
What is the molecular weight of 2-(4-Chlorophenyl)-5,5-dimethyl-4,5-dihydrooxazole?
The molecular weight of 2-(4-Chlorophenyl)-5,5-dimethyl-4,5-dihydrooxazole is 209.06 g/mol.
Where can I buy 2-(4-Chlorophenyl)-5,5-dimethyl-4,5-dihydrooxazole?
You can request a quote for 2-(4-Chlorophenyl)-5,5-dimethyl-4,5-dihydrooxazole directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 2-(4-Chlorophenyl)-5,5-dimethyl-4,5-dihydrooxazole?
Yes, KEHONG BIO provides custom synthesis services for 2-(4-Chlorophenyl)-5,5-dimethyl-4,5-dihydrooxazole and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.