Oxazole, 5-(2-chloroethyl)-4-methyl-
TL;DR: Oxazole, 5-(2-chloroethyl)-4-methyl- (CAS 823-51-8) is a chemical compound with molecular formula C6H8ClNO and molecular weight 145.03 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
5-(2-chloroethyl)-4-methyl-1,3-oxazole
Also Known As: 5-(2-Chloroethyl)-4-methyloxazole, Oxazole, 5-(2-chloroethyl)-4-methyl-, 5-(2-chloroethyl)-4-methyl-1,3-oxazole, BRN 0508488, RefChem:367256
| Molecular Formula | C6H8ClNO |
|---|---|
| Molecular Weight | 145.03 g/mol |
| LogP | 1.6 |
| Topological Polar Surface Area | 26.0 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 2 |
| Rotatable Bonds | 2 |
| Exact Mass | 145.02943 |
| Heavy Atoms | 9 |
| Complexity | 89.0 |
Chemical Identifiers
| CAS Number | 823-51-8 |
|---|---|
| SMILES | CC1=C(OC=N1)CCCl |
| InChIKey | OPEWYSQEEVSRAK-UHFFFAOYSA-N |
Patent-Derived Application Labels
Derived from 5 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
Oxazole, 5-(2-chloroethyl)-4-methyl- (CAS 823-51-8), with molecular formula C6H8ClNO and molecular weight 145.03 g/mol. IUPAC: 5-(2-chloroethyl)-4-methyl-1,3-oxazole.
Chemical Property Profile of Oxazole, 5-(2-chloroethyl)-4-methyl-
Property Insights of Oxazole, 5-(2-chloroethyl)-4-methyl-
The XLogP value of 1.6 suggests moderate lipophilicity, balancing water solubility and membrane permeability for Oxazole, 5-(2-chloroethyl)-4-methyl-. With a topological polar surface area (TPSA) of 26.0 Ų, Oxazole, 5-(2-chloroethyl)-4-methyl- exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, Oxazole, 5-(2-chloroethyl)-4-methyl- 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 Oxazole, 5-(2-chloroethyl)-4-methyl-?
The CAS number of Oxazole, 5-(2-chloroethyl)-4-methyl- is 823-51-8.
What is the molecular formula of Oxazole, 5-(2-chloroethyl)-4-methyl-?
The molecular formula of Oxazole, 5-(2-chloroethyl)-4-methyl- is C6H8ClNO.
What is the molecular weight of Oxazole, 5-(2-chloroethyl)-4-methyl-?
The molecular weight of Oxazole, 5-(2-chloroethyl)-4-methyl- is 145.03 g/mol.
Where can I buy Oxazole, 5-(2-chloroethyl)-4-methyl-?
You can request a quote for Oxazole, 5-(2-chloroethyl)-4-methyl- directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Oxazole, 5-(2-chloroethyl)-4-methyl-?
Yes, KEHONG BIO provides custom synthesis services for Oxazole, 5-(2-chloroethyl)-4-methyl- and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.