5-Benzofuranacetic acid, 2,3-dihydro-alpha-methyl-2-oxo-3-phenyl-, methyl ester
TL;DR: 5-Benzofuranacetic acid, 2,3-dihydro-alpha-methyl-2-oxo-3-phenyl-, methyl ester (CAS 77143-64-7) is a chemical compound with molecular formula C18H16O4 and molecular weight 296.10 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
methyl 2-(2-oxo-3-phenyl-3H-1-benzofuran-5-yl)propanoate
Also Known As: 2,3-Dihydro-alpha-methyl-2-oxo-3-phenyl-5-benzofuranacetic acid methyl ester, 5-Benzofuranacetic acid, 2,3-dihydro-alpha-methyl-2-oxo-3-phenyl-, methyl ester, methyl 2-(2-oxo-3-phenyl-3H-1-benzofuran-5-yl)propanoate, Methyl 2-(2-oxo-3-phenyl-2,3-dihydro-1-benzofuran-5-yl)propanoate, RefChem:1072648
| Molecular Formula | C18H16O4 |
|---|---|
| Molecular Weight | 296.10 g/mol |
| LogP | 3.014 |
| Topological Polar Surface Area | 52.6 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 3 |
| Exact Mass | 296.10486 |
| Heavy Atoms | 22 |
| Complexity | 721.12195 |
Chemical Identifiers
| CAS Number | 77143-64-7 |
|---|---|
| SMILES | CC(C1=CC2=C(C=C1)OC(=O)C2C3=CC=CC=C3)C(=O)OC |
Product Overview
5-Benzofuranacetic acid, 2,3-dihydro-alpha-methyl-2-oxo-3-phenyl-, methyl ester (CAS 77143-64-7), with molecular formula C18H16O4 and molecular weight 296.10 g/mol. IUPAC: methyl 2-(2-oxo-3-phenyl-3H-1-benzofuran-5-yl)propanoate.
Chemical Property Profile of 5-Benzofuranacetic acid, 2,3-dihydro-alpha-methyl-2-oxo-3-phenyl-, methyl ester
Property Insights of 5-Benzofuranacetic acid, 2,3-dihydro-alpha-methyl-2-oxo-3-phenyl-, methyl ester
The XLogP value of 3.014 indicates that 5-Benzofuranacetic acid, 2,3-dihydro-alpha-methyl-2-oxo-3-phenyl-, methyl ester is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 52.6 Ų, 5-Benzofuranacetic acid, 2,3-dihydro-alpha-methyl-2-oxo-3-phenyl-, methyl ester exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 5-Benzofuranacetic acid, 2,3-dihydro-alpha-methyl-2-oxo-3-phenyl-, 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 5-Benzofuranacetic acid, 2,3-dihydro-alpha-methyl-2-oxo-3-phenyl-, methyl ester?
The CAS number of 5-Benzofuranacetic acid, 2,3-dihydro-alpha-methyl-2-oxo-3-phenyl-, methyl ester is 77143-64-7.
What is the molecular formula of 5-Benzofuranacetic acid, 2,3-dihydro-alpha-methyl-2-oxo-3-phenyl-, methyl ester?
The molecular formula of 5-Benzofuranacetic acid, 2,3-dihydro-alpha-methyl-2-oxo-3-phenyl-, methyl ester is C18H16O4.
What is the molecular weight of 5-Benzofuranacetic acid, 2,3-dihydro-alpha-methyl-2-oxo-3-phenyl-, methyl ester?
The molecular weight of 5-Benzofuranacetic acid, 2,3-dihydro-alpha-methyl-2-oxo-3-phenyl-, methyl ester is 296.10 g/mol.
Where can I buy 5-Benzofuranacetic acid, 2,3-dihydro-alpha-methyl-2-oxo-3-phenyl-, methyl ester?
You can request a quote for 5-Benzofuranacetic acid, 2,3-dihydro-alpha-methyl-2-oxo-3-phenyl-, methyl ester directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 5-Benzofuranacetic acid, 2,3-dihydro-alpha-methyl-2-oxo-3-phenyl-, methyl ester?
Yes, KEHONG BIO provides custom synthesis services for 5-Benzofuranacetic acid, 2,3-dihydro-alpha-methyl-2-oxo-3-phenyl-, methyl ester and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.