2-(2-Chlorophenyl)-4,5-dihydro-4,4-dimethyloxazole
TL;DR: 2-(2-Chlorophenyl)-4,5-dihydro-4,4-dimethyloxazole (CAS 98191-99-2) 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-(2-chlorophenyl)-4,4-dimethyl-5H-1,3-oxazole
Also Known As: 2-(2-CHLOROPHENYL)-4,5-DIHYDRO-4,4-DIMETHYLOXAZOLE, 2-(2-Chlorophenyl)-4,4-dimethyl-4,5-dihydrooxazole, 2-(2-chlorophenyl)-4,4-dimethyl-5H-1,3-oxazole, oxazole, 2-(2-chlorophenyl)-4,5-dihydro-4,4-dimethyl-, 2-(2-chlorophenyl)-4,4-dimethyl-4,5-dihydro-1,3-oxazole
| Molecular Formula | C11H12ClNO |
|---|---|
| Molecular Weight | 209.06 g/mol |
| LogP | 2.7 |
| Topological Polar Surface Area | 21.6 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 2 |
| Rotatable Bonds | 1 |
| Exact Mass | 209.06075 |
| Heavy Atoms | 14 |
| Complexity | 250.0 |
Chemical Identifiers
| CAS Number | 98191-99-2 |
|---|---|
| SMILES | CC1(COC(=N1)C2=CC=CC=C2Cl)C |
| InChIKey | VOMZEVDJNHHMLC-UHFFFAOYSA-N |
Patent-Derived Application Labels
Derived from 3 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
2-(2-Chlorophenyl)-4,5-dihydro-4,4-dimethyloxazole (CAS 98191-99-2), with molecular formula C11H12ClNO and molecular weight 209.06 g/mol. IUPAC: 2-(2-chlorophenyl)-4,4-dimethyl-5H-1,3-oxazole.
Chemical Property Profile of 2-(2-Chlorophenyl)-4,5-dihydro-4,4-dimethyloxazole
Property Insights of 2-(2-Chlorophenyl)-4,5-dihydro-4,4-dimethyloxazole
The XLogP value of 2.7 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 2-(2-Chlorophenyl)-4,5-dihydro-4,4-dimethyloxazole. With a topological polar surface area (TPSA) of 21.6 Ų, 2-(2-Chlorophenyl)-4,5-dihydro-4,4-dimethyloxazole exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 2-(2-Chlorophenyl)-4,5-dihydro-4,4-dimethyloxazole 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-(2-Chlorophenyl)-4,5-dihydro-4,4-dimethyloxazole?
The CAS number of 2-(2-Chlorophenyl)-4,5-dihydro-4,4-dimethyloxazole is 98191-99-2.
What is the molecular formula of 2-(2-Chlorophenyl)-4,5-dihydro-4,4-dimethyloxazole?
The molecular formula of 2-(2-Chlorophenyl)-4,5-dihydro-4,4-dimethyloxazole is C11H12ClNO.
What is the molecular weight of 2-(2-Chlorophenyl)-4,5-dihydro-4,4-dimethyloxazole?
The molecular weight of 2-(2-Chlorophenyl)-4,5-dihydro-4,4-dimethyloxazole is 209.06 g/mol.
Where can I buy 2-(2-Chlorophenyl)-4,5-dihydro-4,4-dimethyloxazole?
You can request a quote for 2-(2-Chlorophenyl)-4,5-dihydro-4,4-dimethyloxazole directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 2-(2-Chlorophenyl)-4,5-dihydro-4,4-dimethyloxazole?
Yes, KEHONG BIO provides custom synthesis services for 2-(2-Chlorophenyl)-4,5-dihydro-4,4-dimethyloxazole and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.