Furan-2-carboxylic acid 2-oxo-2-phenyl-ethyl ester
TL;DR: Furan-2-carboxylic acid 2-oxo-2-phenyl-ethyl ester (CAS 107692-59-1) is a chemical compound with molecular formula C13H10O4 and molecular weight 230.06 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
phenacyl furan-2-carboxylate
Also Known As: phenacyl furan-2-carboxylate, 2-oxo-2-phenylethyl 2-furoate, 2-Oxo-2-phenylethyl 2-furancarboxylate, BAS 00903501, Furan-2-carboxylic acid 2-oxo-2-phenyl-ethyl ester
| Molecular Formula | C13H10O4 |
|---|---|
| Molecular Weight | 230.06 g/mol |
| LogP | 2.6 |
| Topological Polar Surface Area | 56.5 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 5 |
| Exact Mass | 230.0579 |
| Heavy Atoms | 17 |
| Complexity | 281.0 |
Chemical Identifiers
| CAS Number | 107692-59-1 |
|---|---|
| SMILES | C1=CC=C(C=C1)C(=O)COC(=O)C2=CC=CO2 |
| InChIKey | LQIHFTAJSUTWLW-UHFFFAOYSA-N |
Patent-Derived Application Labels
Derived from 2 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
Furan-2-carboxylic acid 2-oxo-2-phenyl-ethyl ester (CAS 107692-59-1), with molecular formula C13H10O4 and molecular weight 230.06 g/mol. IUPAC: phenacyl furan-2-carboxylate.
Chemical Property Profile of Furan-2-carboxylic acid 2-oxo-2-phenyl-ethyl ester
Property Insights of Furan-2-carboxylic acid 2-oxo-2-phenyl-ethyl ester
The XLogP value of 2.6 suggests moderate lipophilicity, balancing water solubility and membrane permeability for Furan-2-carboxylic acid 2-oxo-2-phenyl-ethyl ester. With a topological polar surface area (TPSA) of 56.5 Ų, Furan-2-carboxylic acid 2-oxo-2-phenyl-ethyl ester exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, Furan-2-carboxylic acid 2-oxo-2-phenyl-ethyl 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 Furan-2-carboxylic acid 2-oxo-2-phenyl-ethyl ester?
The CAS number of Furan-2-carboxylic acid 2-oxo-2-phenyl-ethyl ester is 107692-59-1.
What is the molecular formula of Furan-2-carboxylic acid 2-oxo-2-phenyl-ethyl ester?
The molecular formula of Furan-2-carboxylic acid 2-oxo-2-phenyl-ethyl ester is C13H10O4.
What is the molecular weight of Furan-2-carboxylic acid 2-oxo-2-phenyl-ethyl ester?
The molecular weight of Furan-2-carboxylic acid 2-oxo-2-phenyl-ethyl ester is 230.06 g/mol.
Where can I buy Furan-2-carboxylic acid 2-oxo-2-phenyl-ethyl ester?
You can request a quote for Furan-2-carboxylic acid 2-oxo-2-phenyl-ethyl ester directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Furan-2-carboxylic acid 2-oxo-2-phenyl-ethyl ester?
Yes, KEHONG BIO provides custom synthesis services for Furan-2-carboxylic acid 2-oxo-2-phenyl-ethyl ester and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.