Benzoxazole, 2-methyl-5-phenyl-
TL;DR: Benzoxazole, 2-methyl-5-phenyl- (CAS 61931-68-8) is a chemical compound with molecular formula C14H11NO and molecular weight 209.08406 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
2-methyl-5-phenyl-1,3-benzoxazole
Also Known As: 2-Methyl-5-phenylbenzoxazole, 2-Methyl-5-phenylbenzo[d]oxazole, 2-Methyl-5-phenyl-1,3-benzoxazole, Benzoxazole, 2-methyl-5-phenyl-, 2-Methyl-5-phenyl-benzooxazole
Application Areas
Top 5 of 5 IPC patent classification(s) from the SureChEMBL global patent database.
Technical Specifications
| Molecular Formula | C14H11NO |
| Molecular Weight | 209.08406 g/mol |
| XLogP | 3.8 |
| Topological Polar Surface Area (TPSA) | 26.0 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 2 |
| Rotatable Bonds | 1 |
| Exact Mass | 209.08406 Da |
| Heavy Atoms | 16 |
| Complexity | 237.0 |
| SMILES | CC1=NC2=C(O1)C=CC(=C2)C3=CC=CC=C3 |
| InChIKey | CHZDPBVCBBQQRP-UHFFFAOYSA-N |
Chemical Property Profile of Benzoxazole, 2-methyl-5-phenyl-
Property Insights of Benzoxazole, 2-methyl-5-phenyl-
The XLogP value of 3.8 indicates that Benzoxazole, 2-methyl-5-phenyl- is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 26.0 Ų, Benzoxazole, 2-methyl-5-phenyl- exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, Benzoxazole, 2-methyl-5-phenyl- 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 Benzoxazole, 2-methyl-5-phenyl-?
The CAS number of Benzoxazole, 2-methyl-5-phenyl- is 61931-68-8.
What is the molecular formula of Benzoxazole, 2-methyl-5-phenyl-?
The molecular formula of Benzoxazole, 2-methyl-5-phenyl- is C14H11NO.
What is the molecular weight of Benzoxazole, 2-methyl-5-phenyl-?
The molecular weight of Benzoxazole, 2-methyl-5-phenyl- is 209.08406 g/mol.
Where can I buy Benzoxazole, 2-methyl-5-phenyl-?
You can request a quote for Benzoxazole, 2-methyl-5-phenyl- directly from CoreyChem. Contact us or email [email protected] for pricing and availability.
Does CoreyChem offer custom synthesis for Benzoxazole, 2-methyl-5-phenyl-?
Yes, CoreyChem provides custom synthesis services for Benzoxazole, 2-methyl-5-phenyl- and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.