5-Chloro-2-ethyl-1,3-benzoxazole
TL;DR: 5-Chloro-2-ethyl-1,3-benzoxazole (CAS 153275-47-9) is a chemical compound with molecular formula C9H8ClNO and molecular weight 181.03 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
5-chloro-2-ethyl-1,3-benzoxazole
Also Known As: 2-Ethyl-5-chlorobenzoxazole, Benzoxazole, 5-chloro-2-ethyl-, 5-chloro-2-ethyl-benzooxazole, 5-chloro-2-ethyl-1,3-benzoxazole
| Molecular Formula | C9H8ClNO |
|---|---|
| Molecular Weight | 181.03 g/mol |
| LogP | 3.0436 |
| Topological Polar Surface Area | 26.03 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 2 |
| Rotatable Bonds | 1 |
| Exact Mass | 181.02943 |
| Heavy Atoms | 12 |
| Complexity | 407.82077 |
Chemical Identifiers
| CAS Number | 153275-47-9 |
|---|---|
| SMILES | CCC1=NC2=C(O1)C=CC(=C2)Cl |
Product Overview
5-Chloro-2-ethyl-1,3-benzoxazole (CAS 153275-47-9), with molecular formula C9H8ClNO and molecular weight 181.03 g/mol. IUPAC: 5-chloro-2-ethyl-1,3-benzoxazole.
Chemical Property Profile of 5-Chloro-2-ethyl-1,3-benzoxazole
Property Insights of 5-Chloro-2-ethyl-1,3-benzoxazole
The XLogP value of 3.0436 indicates that 5-Chloro-2-ethyl-1,3-benzoxazole is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 26.03 Ų, 5-Chloro-2-ethyl-1,3-benzoxazole exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 5-Chloro-2-ethyl-1,3-benzoxazole 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 5-Chloro-2-ethyl-1,3-benzoxazole?
The CAS number of 5-Chloro-2-ethyl-1,3-benzoxazole is 153275-47-9.
What is the molecular formula of 5-Chloro-2-ethyl-1,3-benzoxazole?
The molecular formula of 5-Chloro-2-ethyl-1,3-benzoxazole is C9H8ClNO.
What is the molecular weight of 5-Chloro-2-ethyl-1,3-benzoxazole?
The molecular weight of 5-Chloro-2-ethyl-1,3-benzoxazole is 181.03 g/mol.
Where can I buy 5-Chloro-2-ethyl-1,3-benzoxazole?
You can request a quote for 5-Chloro-2-ethyl-1,3-benzoxazole directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 5-Chloro-2-ethyl-1,3-benzoxazole?
Yes, KEHONG BIO provides custom synthesis services for 5-Chloro-2-ethyl-1,3-benzoxazole and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.