![3-[(4-Methoxyphenyl)methylidene]oxolane-2,4-dione structure](/static/products/6185/61853-41-6.webp)
3-[(4-Methoxyphenyl)methylidene]oxolane-2,4-dione
TL;DR: 3-[(4-Methoxyphenyl)methylidene]oxolane-2,4-dione (CAS 61853-41-6) is a chemical compound with molecular formula C12H10O4 and molecular weight 218.06 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
3-[(4-methoxyphenyl)methylidene]oxolane-2,4-dione
Also Known As: NCIOpen2_004743, 3-(4-methoxybenzylidene)furan-2,4(3h,5h)-dione, 3-[(4-methoxyphenyl)methylidene]oxolane-2,4-dione, (3Z)-3-(4-Methoxybenzylidene)-2,4(3H,5H)-furandione
| Molecular Formula | C12H10O4 |
|---|---|
| Molecular Weight | 218.06 g/mol |
| LogP | 2.0 |
| Topological Polar Surface Area | 52.6 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 2 |
| Exact Mass | 218.0579 |
| Heavy Atoms | 16 |
| Complexity | 324.0 |
Chemical Identifiers
| CAS Number | 61853-41-6 |
|---|---|
| SMILES | COC1=CC=C(C=C1)C=C2C(=O)COC2=O |
| InChIKey | IJNACORLSWPDBH-UHFFFAOYSA-N |
Patent-Derived Application Labels
Derived from 2 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
3-[(4-Methoxyphenyl)methylidene]oxolane-2,4-dione (CAS 61853-41-6), with molecular formula C12H10O4 and molecular weight 218.06 g/mol. IUPAC: 3-[(4-methoxyphenyl)methylidene]oxolane-2,4-dione.
Chemical Property Profile of 3-[(4-Methoxyphenyl)methylidene]oxolane-2,4-dione
Property Insights of 3-[(4-Methoxyphenyl)methylidene]oxolane-2,4-dione
The XLogP value of 2.0 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 3-[(4-Methoxyphenyl)methylidene]oxolane-2,4-dione. With a topological polar surface area (TPSA) of 52.6 Ų, 3-[(4-Methoxyphenyl)methylidene]oxolane-2,4-dione exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 3-[(4-Methoxyphenyl)methylidene]oxolane-2,4-dione 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 3-[(4-Methoxyphenyl)methylidene]oxolane-2,4-dione?
The CAS number of 3-[(4-Methoxyphenyl)methylidene]oxolane-2,4-dione is 61853-41-6.
What is the molecular formula of 3-[(4-Methoxyphenyl)methylidene]oxolane-2,4-dione?
The molecular formula of 3-[(4-Methoxyphenyl)methylidene]oxolane-2,4-dione is C12H10O4.
What is the molecular weight of 3-[(4-Methoxyphenyl)methylidene]oxolane-2,4-dione?
The molecular weight of 3-[(4-Methoxyphenyl)methylidene]oxolane-2,4-dione is 218.06 g/mol.
Where can I buy 3-[(4-Methoxyphenyl)methylidene]oxolane-2,4-dione?
You can request a quote for 3-[(4-Methoxyphenyl)methylidene]oxolane-2,4-dione directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 3-[(4-Methoxyphenyl)methylidene]oxolane-2,4-dione?
Yes, KEHONG BIO provides custom synthesis services for 3-[(4-Methoxyphenyl)methylidene]oxolane-2,4-dione and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.