![5(4H)-Isoxazolone, 4-[(2-methoxyphenyl)methylene]-3-methyl- structure](/static/products/6136/61365-95-5.webp)
5(4H)-Isoxazolone, 4-[(2-methoxyphenyl)methylene]-3-methyl-
TL;DR: 5(4H)-Isoxazolone, 4-[(2-methoxyphenyl)methylene]-3-methyl- (CAS 61365-95-5) is a chemical compound with molecular formula C12H11NO3 and molecular weight 217.07 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
4-[(2-methoxyphenyl)methylidene]-3-methyl-1,2-oxazol-5-one
Also Known As: ChemDiv3_002500, 4-[(2-methoxyphenyl)methylidene]-3-methyl-1,2-oxazol-5-one, 2,6-Dimethoxy-benzyliden-2,5-cyclohexadien-1-on, 5(4H)-Isoxazolone, 4-[(2-methoxyphenyl)methylene]-3-methyl-, 3-methyl-4-(2-methoxyphenyl)methylene-isoxazole-5(4h)-one
| Molecular Formula | C12H11NO3 |
|---|---|
| Molecular Weight | 217.07 g/mol |
| LogP | 2.2 |
| Topological Polar Surface Area | 47.9 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 2 |
| Exact Mass | 217.0739 |
| Heavy Atoms | 16 |
| Complexity | 346.0 |
Chemical Identifiers
| CAS Number | 61365-95-5 |
|---|---|
| SMILES | CC1=NOC(=O)C1=CC2=CC=CC=C2OC |
| InChIKey | WCVBPLSMUZZOOE-UHFFFAOYSA-N |
Product Overview
5(4H)-Isoxazolone, 4-[(2-methoxyphenyl)methylene]-3-methyl- (CAS 61365-95-5), with molecular formula C12H11NO3 and molecular weight 217.07 g/mol. IUPAC: 4-[(2-methoxyphenyl)methylidene]-3-methyl-1,2-oxazol-5-one.
Chemical Property Profile of 5(4H)-Isoxazolone, 4-[(2-methoxyphenyl)methylene]-3-methyl-
Property Insights of 5(4H)-Isoxazolone, 4-[(2-methoxyphenyl)methylene]-3-methyl-
The XLogP value of 2.2 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 5(4H)-Isoxazolone, 4-[(2-methoxyphenyl)methylene]-3-methyl-. With a topological polar surface area (TPSA) of 47.9 Ų, 5(4H)-Isoxazolone, 4-[(2-methoxyphenyl)methylene]-3-methyl- exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 5(4H)-Isoxazolone, 4-[(2-methoxyphenyl)methylene]-3-methyl- 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
Frequently Asked Questions
What is the CAS number of 5(4H)-Isoxazolone, 4-[(2-methoxyphenyl)methylene]-3-methyl-?
The CAS number of 5(4H)-Isoxazolone, 4-[(2-methoxyphenyl)methylene]-3-methyl- is 61365-95-5.
What is the molecular formula of 5(4H)-Isoxazolone, 4-[(2-methoxyphenyl)methylene]-3-methyl-?
The molecular formula of 5(4H)-Isoxazolone, 4-[(2-methoxyphenyl)methylene]-3-methyl- is C12H11NO3.
What is the molecular weight of 5(4H)-Isoxazolone, 4-[(2-methoxyphenyl)methylene]-3-methyl-?
The molecular weight of 5(4H)-Isoxazolone, 4-[(2-methoxyphenyl)methylene]-3-methyl- is 217.07 g/mol.
Where can I buy 5(4H)-Isoxazolone, 4-[(2-methoxyphenyl)methylene]-3-methyl-?
You can request a quote for 5(4H)-Isoxazolone, 4-[(2-methoxyphenyl)methylene]-3-methyl- directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 5(4H)-Isoxazolone, 4-[(2-methoxyphenyl)methylene]-3-methyl-?
Yes, KEHONG BIO provides custom synthesis services for 5(4H)-Isoxazolone, 4-[(2-methoxyphenyl)methylene]-3-methyl- and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.