4,4-Dimethyl-2-(2-phenylethenyl)-2-oxazoline
TL;DR: 4,4-Dimethyl-2-(2-phenylethenyl)-2-oxazoline (CAS 121578-58-3) is a chemical compound with molecular formula C13H15NO and molecular weight 201.11537 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
4,4-dimethyl-2-(2-phenylethenyl)-5H-1,3-oxazole
Also Known As: 4,4-dimethyl-2-styryl-5H-oxazole, 4,4-Dimethyl-2-(2-phenylethenyl)-2-oxazoline, 4,4-dimethyl-2-styryl-4,5-dihydro-1,3-oxazole, 4,4-dimethyl-2-(2-phenylethenyl)-5H-1,3-oxazole, Oxazole, 4,5-dihydro-4,4-dimethyl-2-[(1Z)-2-phenylethenyl]-
Application Areas
Top 5 of 1 IPC patent classification(s) from the SureChEMBL global patent database.
Technical Specifications
| Molecular Formula | C13H15NO |
| Molecular Weight | 201.11537 g/mol |
| XLogP | 2.5 |
| Topological Polar Surface Area (TPSA) | 21.6 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 2 |
| Rotatable Bonds | 2 |
| Exact Mass | 201.11537 Da |
| Heavy Atoms | 15 |
| Complexity | 272.0 |
| SMILES | CC1(COC(=N1)C=CC2=CC=CC=C2)C |
| InChIKey | IVCSIAZWAKWKDI-UHFFFAOYSA-N |
Chemical Property Profile of 4,4-Dimethyl-2-(2-phenylethenyl)-2-oxazoline
Property Insights of 4,4-Dimethyl-2-(2-phenylethenyl)-2-oxazoline
The XLogP value of 2.5 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 4,4-Dimethyl-2-(2-phenylethenyl)-2-oxazoline. With a topological polar surface area (TPSA) of 21.6 Ų, 4,4-Dimethyl-2-(2-phenylethenyl)-2-oxazoline exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 4,4-Dimethyl-2-(2-phenylethenyl)-2-oxazoline 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
What is the CAS number of 4,4-Dimethyl-2-(2-phenylethenyl)-2-oxazoline?
The CAS number of 4,4-Dimethyl-2-(2-phenylethenyl)-2-oxazoline is 121578-58-3.
What is the molecular formula of 4,4-Dimethyl-2-(2-phenylethenyl)-2-oxazoline?
The molecular formula of 4,4-Dimethyl-2-(2-phenylethenyl)-2-oxazoline is C13H15NO.
What is the molecular weight of 4,4-Dimethyl-2-(2-phenylethenyl)-2-oxazoline?
The molecular weight of 4,4-Dimethyl-2-(2-phenylethenyl)-2-oxazoline is 201.11537 g/mol.
Where can I buy 4,4-Dimethyl-2-(2-phenylethenyl)-2-oxazoline?
You can request a quote for 4,4-Dimethyl-2-(2-phenylethenyl)-2-oxazoline directly from CoreyChem. Contact us or email [email protected] for pricing and availability.
Does CoreyChem offer custom synthesis for 4,4-Dimethyl-2-(2-phenylethenyl)-2-oxazoline?
Yes, CoreyChem provides custom synthesis services for 4,4-Dimethyl-2-(2-phenylethenyl)-2-oxazoline and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.