![4-[(2-Methyl-5-oxo-1,3-oxazol-4(5h)-ylidene)methyl]phenyl acetate structure](/static/products/6047/60470-81-7.webp)
4-[(2-Methyl-5-oxo-1,3-oxazol-4(5h)-ylidene)methyl]phenyl acetate
TL;DR: 4-[(2-Methyl-5-oxo-1,3-oxazol-4(5h)-ylidene)methyl]phenyl acetate (CAS 60470-81-7) is a chemical compound with molecular formula C13H11NO4 and molecular weight 245.07 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
[4-[(2-methyl-5-oxo-1,3-oxazol-4-ylidene)methyl]phenyl] acetate
Also Known As: 4-(4-acetoxybenzylidene)-2-methyloxazol-5(4H)-one, 2-methyl-4-(p-acetoxy-benzylidene)-5(4H)-oxazolone, 4-[(2-methyl-5-oxo-1,3-oxazol-4(5h)-ylidene)methyl]phenyl acetate, [4-[(2-methyl-5-oxo-1,3-oxazol-4-ylidene)methyl]phenyl] acetate, 5(4H)-Oxazolone, 4-[[4-(acetyloxy)phenyl]methylene]-2-methyl-, (Z)-
| Molecular Formula | C13H11NO4 |
|---|---|
| Molecular Weight | 245.07 g/mol |
| LogP | 1.7 |
| Topological Polar Surface Area | 65.0 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 3 |
| Exact Mass | 245.0688 |
| Heavy Atoms | 18 |
| Complexity | 417.0 |
Chemical Identifiers
| CAS Number | 60470-81-7 |
|---|---|
| SMILES | CC1=NC(=CC2=CC=C(C=C2)OC(=O)C)C(=O)O1 |
| InChIKey | IIFDOCUPPJXLMD-UHFFFAOYSA-N |
Patent-Derived Application Labels
Derived from 3 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
4-[(2-Methyl-5-oxo-1,3-oxazol-4(5h)-ylidene)methyl]phenyl acetate (CAS 60470-81-7), with molecular formula C13H11NO4 and molecular weight 245.07 g/mol. IUPAC: [4-[(2-methyl-5-oxo-1,3-oxazol-4-ylidene)methyl]phenyl] acetate.
Chemical Property Profile of 4-[(2-Methyl-5-oxo-1,3-oxazol-4(5h)-ylidene)methyl]phenyl acetate
Property Insights of 4-[(2-Methyl-5-oxo-1,3-oxazol-4(5h)-ylidene)methyl]phenyl acetate
The XLogP value of 1.7 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 4-[(2-Methyl-5-oxo-1,3-oxazol-4(5h)-ylidene)methyl]phenyl acetate. The TPSA of 65.0 Ų falls within the moderate polarity range, balancing permeability and solubility for 4-[(2-Methyl-5-oxo-1,3-oxazol-4(5h)-ylidene)methyl]phenyl acetate. Following Lipinski's Rule of Five, 4-[(2-Methyl-5-oxo-1,3-oxazol-4(5h)-ylidene)methyl]phenyl acetate has 0 hydrogen bond donor(s) and 5 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 4-[(2-Methyl-5-oxo-1,3-oxazol-4(5h)-ylidene)methyl]phenyl acetate?
The CAS number of 4-[(2-Methyl-5-oxo-1,3-oxazol-4(5h)-ylidene)methyl]phenyl acetate is 60470-81-7.
What is the molecular formula of 4-[(2-Methyl-5-oxo-1,3-oxazol-4(5h)-ylidene)methyl]phenyl acetate?
The molecular formula of 4-[(2-Methyl-5-oxo-1,3-oxazol-4(5h)-ylidene)methyl]phenyl acetate is C13H11NO4.
What is the molecular weight of 4-[(2-Methyl-5-oxo-1,3-oxazol-4(5h)-ylidene)methyl]phenyl acetate?
The molecular weight of 4-[(2-Methyl-5-oxo-1,3-oxazol-4(5h)-ylidene)methyl]phenyl acetate is 245.07 g/mol.
Where can I buy 4-[(2-Methyl-5-oxo-1,3-oxazol-4(5h)-ylidene)methyl]phenyl acetate?
You can request a quote for 4-[(2-Methyl-5-oxo-1,3-oxazol-4(5h)-ylidene)methyl]phenyl acetate directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 4-[(2-Methyl-5-oxo-1,3-oxazol-4(5h)-ylidene)methyl]phenyl acetate?
Yes, KEHONG BIO provides custom synthesis services for 4-[(2-Methyl-5-oxo-1,3-oxazol-4(5h)-ylidene)methyl]phenyl acetate and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.