Phenol, 4-(2-benzoxazoyl)-, acetate (ester)
TL;DR: Phenol, 4-(2-benzoxazoyl)-, acetate (ester) (CAS 100476-57-1) is a chemical compound with molecular formula C15H11NO3 and molecular weight 253.0739 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
[4-(1,3-benzoxazol-2-yl)phenyl] acetate
Also Known As: Phenol, 4-(2-benzoxazoyl)-, acetate (ester), 4-(2-Benzoxazoyl)phenol acetate (ester), [4-(1,3-benzoxazol-2-yl)phenyl] acetate, 4-(1,3-benzoxazol-2-yl)phenyl acetate, phenol, 4-(2-benzoxazolyl)-, 1-acetate
Technical Specifications
| Molecular Formula | C15H11NO3 |
| Molecular Weight | 253.0739 g/mol |
| XLogP | 3.2 |
| Topological Polar Surface Area (TPSA) | 52.3 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 3 |
| Exact Mass | 253.0739 Da |
| Heavy Atoms | 19 |
| Complexity | 325.0 |
| SMILES | CC(=O)OC1=CC=C(C=C1)C2=NC3=CC=CC=C3O2 |
| InChIKey | SAPQLVFYZNYGSV-UHFFFAOYSA-N |
Chemical Property Profile of Phenol, 4-(2-benzoxazoyl)-, acetate (ester)
Property Insights of Phenol, 4-(2-benzoxazoyl)-, acetate (ester)
The XLogP value of 3.2 indicates that Phenol, 4-(2-benzoxazoyl)-, acetate (ester) is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 52.3 Ų, Phenol, 4-(2-benzoxazoyl)-, acetate (ester) exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, Phenol, 4-(2-benzoxazoyl)-, acetate (ester) 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
What is the CAS number of Phenol, 4-(2-benzoxazoyl)-, acetate (ester)?
The CAS number of Phenol, 4-(2-benzoxazoyl)-, acetate (ester) is 100476-57-1.
What is the molecular formula of Phenol, 4-(2-benzoxazoyl)-, acetate (ester)?
The molecular formula of Phenol, 4-(2-benzoxazoyl)-, acetate (ester) is C15H11NO3.
What is the molecular weight of Phenol, 4-(2-benzoxazoyl)-, acetate (ester)?
The molecular weight of Phenol, 4-(2-benzoxazoyl)-, acetate (ester) is 253.0739 g/mol.
Where can I buy Phenol, 4-(2-benzoxazoyl)-, acetate (ester)?
You can request a quote for Phenol, 4-(2-benzoxazoyl)-, acetate (ester) directly from CoreyChem. Contact us or email [email protected] for pricing and availability.
Does CoreyChem offer custom synthesis for Phenol, 4-(2-benzoxazoyl)-, acetate (ester)?
Yes, CoreyChem provides custom synthesis services for Phenol, 4-(2-benzoxazoyl)-, acetate (ester) and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.