2-Methoxycarbonylmethylene-5-p-chlorophenyl-2,3-di-hydro-3-furanone
TL;DR: 2-Methoxycarbonylmethylene-5-p-chlorophenyl-2,3-di-hydro-3-furanone (CAS 97181-00-5) is a chemical compound with molecular formula C13H9ClO4 and molecular weight 264.02 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
methyl 2-[5-(4-chlorophenyl)-3-oxofuran-2-ylidene]acetate
Also Known As: methyl 2-[5-(4-chlorophenyl)-3-oxofuran-2-ylidene]acetate, 2-methoxycarbonylmethylene-5-p-chlorophenyl-2,3-di-hydro-3-furanone, METHYL (2Z)-2-[5-(4-CHLOROPHENYL)-3-OXO-2-FURYLIDENE]ACETATE
| Molecular Formula | C13H9ClO4 |
|---|---|
| Molecular Weight | 264.02 g/mol |
| LogP | 2.3371 |
| Topological Polar Surface Area | 52.6 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 2 |
| Exact Mass | 264.01895 |
| Heavy Atoms | 18 |
| Complexity | 554.8589 |
Chemical Identifiers
| CAS Number | 97181-00-5 |
|---|---|
| SMILES | COC(=O)C=C1C(=O)C=C(O1)C2=CC=C(C=C2)Cl |
Product Overview
2-Methoxycarbonylmethylene-5-p-chlorophenyl-2,3-di-hydro-3-furanone (CAS 97181-00-5), with molecular formula C13H9ClO4 and molecular weight 264.02 g/mol. IUPAC: methyl 2-[5-(4-chlorophenyl)-3-oxofuran-2-ylidene]acetate.
Chemical Property Profile of 2-Methoxycarbonylmethylene-5-p-chlorophenyl-2,3-di-hydro-3-furanone
Property Insights of 2-Methoxycarbonylmethylene-5-p-chlorophenyl-2,3-di-hydro-3-furanone
The XLogP value of 2.3371 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 2-Methoxycarbonylmethylene-5-p-chlorophenyl-2,3-di-hydro-3-furanone. With a topological polar surface area (TPSA) of 52.6 Ų, 2-Methoxycarbonylmethylene-5-p-chlorophenyl-2,3-di-hydro-3-furanone exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 2-Methoxycarbonylmethylene-5-p-chlorophenyl-2,3-di-hydro-3-furanone 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 2-Methoxycarbonylmethylene-5-p-chlorophenyl-2,3-di-hydro-3-furanone?
The CAS number of 2-Methoxycarbonylmethylene-5-p-chlorophenyl-2,3-di-hydro-3-furanone is 97181-00-5.
What is the molecular formula of 2-Methoxycarbonylmethylene-5-p-chlorophenyl-2,3-di-hydro-3-furanone?
The molecular formula of 2-Methoxycarbonylmethylene-5-p-chlorophenyl-2,3-di-hydro-3-furanone is C13H9ClO4.
What is the molecular weight of 2-Methoxycarbonylmethylene-5-p-chlorophenyl-2,3-di-hydro-3-furanone?
The molecular weight of 2-Methoxycarbonylmethylene-5-p-chlorophenyl-2,3-di-hydro-3-furanone is 264.02 g/mol.
Where can I buy 2-Methoxycarbonylmethylene-5-p-chlorophenyl-2,3-di-hydro-3-furanone?
You can request a quote for 2-Methoxycarbonylmethylene-5-p-chlorophenyl-2,3-di-hydro-3-furanone directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 2-Methoxycarbonylmethylene-5-p-chlorophenyl-2,3-di-hydro-3-furanone?
Yes, KEHONG BIO provides custom synthesis services for 2-Methoxycarbonylmethylene-5-p-chlorophenyl-2,3-di-hydro-3-furanone and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.