![2-[5-(2-Oxopropyl)furan-2-yl]propanoic acid, methyl ester structure](/static/products/545/54541-03-6.png)
2-[5-(2-Oxopropyl)furan-2-yl]propanoic acid, methyl ester
TL;DR: 2-[5-(2-Oxopropyl)furan-2-yl]propanoic acid, methyl ester (CAS 54541-03-6) is a chemical compound with molecular formula C11H14O4 and molecular weight 210.09 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
methyl 2-[5-(2-oxopropyl)furan-2-yl]propanoate
Also Known As: Methyl 2-[5-(2-oxopropyl)-2-furyl]propanoate, methyl 2-[5-(2-oxopropyl)furan-2-yl]propanoate, Methyl 2-[5-(2-oxopropyl)-2-furyl]propanoate #, 2-[5-(2-oxo-propyl)-furan-2-yl]-propionic acid methyl ester, 2-[5-(2-Oxopropyl)furan-2-yl]propanoic acid, methyl ester
| Molecular Formula | C11H14O4 |
|---|---|
| Molecular Weight | 210.09 g/mol |
| LogP | 1.0 |
| Topological Polar Surface Area | 56.5 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 5 |
| Exact Mass | 210.0892 |
| Heavy Atoms | 15 |
| Complexity | 249.0 |
Chemical Identifiers
| CAS Number | 54541-03-6 |
|---|---|
| SMILES | CC(C1=CC=C(O1)CC(=O)C)C(=O)OC |
| InChIKey | SEFGJHUBFBPGON-UHFFFAOYSA-N |
Product Overview
2-[5-(2-Oxopropyl)furan-2-yl]propanoic acid, methyl ester (CAS 54541-03-6), with molecular formula C11H14O4 and molecular weight 210.09 g/mol. IUPAC: methyl 2-[5-(2-oxopropyl)furan-2-yl]propanoate.
Chemical Property Profile of 2-[5-(2-Oxopropyl)furan-2-yl]propanoic acid, methyl ester
Property Insights of 2-[5-(2-Oxopropyl)furan-2-yl]propanoic acid, methyl ester
The XLogP value of 1.0 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 2-[5-(2-Oxopropyl)furan-2-yl]propanoic acid, methyl ester. With a topological polar surface area (TPSA) of 56.5 Ų, 2-[5-(2-Oxopropyl)furan-2-yl]propanoic acid, methyl ester exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 2-[5-(2-Oxopropyl)furan-2-yl]propanoic acid, methyl ester 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-[5-(2-Oxopropyl)furan-2-yl]propanoic acid, methyl ester?
The CAS number of 2-[5-(2-Oxopropyl)furan-2-yl]propanoic acid, methyl ester is 54541-03-6.
What is the molecular formula of 2-[5-(2-Oxopropyl)furan-2-yl]propanoic acid, methyl ester?
The molecular formula of 2-[5-(2-Oxopropyl)furan-2-yl]propanoic acid, methyl ester is C11H14O4.
What is the molecular weight of 2-[5-(2-Oxopropyl)furan-2-yl]propanoic acid, methyl ester?
The molecular weight of 2-[5-(2-Oxopropyl)furan-2-yl]propanoic acid, methyl ester is 210.09 g/mol.
Where can I buy 2-[5-(2-Oxopropyl)furan-2-yl]propanoic acid, methyl ester?
You can request a quote for 2-[5-(2-Oxopropyl)furan-2-yl]propanoic acid, methyl ester directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 2-[5-(2-Oxopropyl)furan-2-yl]propanoic acid, methyl ester?
Yes, KEHONG BIO provides custom synthesis services for 2-[5-(2-Oxopropyl)furan-2-yl]propanoic acid, methyl ester and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.