5-Chloro-2-phenyl-4-oxazolecarboxaldehyde
TL;DR: 5-Chloro-2-phenyl-4-oxazolecarboxaldehyde (CAS 54644-13-2) is a chemical compound with molecular formula C10H6ClNO2 and molecular weight 207.01 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
5-chloro-2-phenyl-1,3-oxazole-4-carbaldehyde
Also Known As: 5-chloro-2-phenyloxazole-4-carbaldehyde, 5-Chloro-2-phenyl-4-oxazolecarboxaldehyde, 5-Chlor-2-phenyl-oxazol-4-carbaldehyd, 5-chloro-2-phenyl-1,3-oxazole-4-carbaldehyde, J2.902.037J
| Molecular Formula | C10H6ClNO2 |
|---|---|
| Molecular Weight | 207.01 g/mol |
| LogP | 2.8075 |
| Topological Polar Surface Area | 43.1 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 2 |
| Exact Mass | 207.00871 |
| Heavy Atoms | 14 |
| Complexity | 450.40048 |
Chemical Identifiers
| CAS Number | 54644-13-2 |
|---|---|
| SMILES | C1=CC=C(C=C1)C2=NC(=C(O2)Cl)C=O |
Product Overview
5-Chloro-2-phenyl-4-oxazolecarboxaldehyde (CAS 54644-13-2), with molecular formula C10H6ClNO2 and molecular weight 207.01 g/mol. IUPAC: 5-chloro-2-phenyl-1,3-oxazole-4-carbaldehyde.
Chemical Property Profile of 5-Chloro-2-phenyl-4-oxazolecarboxaldehyde
Property Insights of 5-Chloro-2-phenyl-4-oxazolecarboxaldehyde
The XLogP value of 2.8075 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 5-Chloro-2-phenyl-4-oxazolecarboxaldehyde. With a topological polar surface area (TPSA) of 43.1 Ų, 5-Chloro-2-phenyl-4-oxazolecarboxaldehyde exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 5-Chloro-2-phenyl-4-oxazolecarboxaldehyde has 0 hydrogen bond donor(s) and 3 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-phenyl-4-oxazolecarboxaldehyde?
The CAS number of 5-Chloro-2-phenyl-4-oxazolecarboxaldehyde is 54644-13-2.
What is the molecular formula of 5-Chloro-2-phenyl-4-oxazolecarboxaldehyde?
The molecular formula of 5-Chloro-2-phenyl-4-oxazolecarboxaldehyde is C10H6ClNO2.
What is the molecular weight of 5-Chloro-2-phenyl-4-oxazolecarboxaldehyde?
The molecular weight of 5-Chloro-2-phenyl-4-oxazolecarboxaldehyde is 207.01 g/mol.
Where can I buy 5-Chloro-2-phenyl-4-oxazolecarboxaldehyde?
You can request a quote for 5-Chloro-2-phenyl-4-oxazolecarboxaldehyde 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-phenyl-4-oxazolecarboxaldehyde?
Yes, KEHONG BIO provides custom synthesis services for 5-Chloro-2-phenyl-4-oxazolecarboxaldehyde and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.