2,3-Dihydro-3-(4-chlorophenyl)-alpha-methyl-2-oxo-5-benzofuranacetic acid methyl ester
TL;DR: 2,3-Dihydro-3-(4-chlorophenyl)-alpha-methyl-2-oxo-5-benzofuranacetic acid methyl ester (CAS 77143-65-8) is a chemical compound with molecular formula C18H15ClO4 and molecular weight 330.07 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
methyl 2-[3-(4-chlorophenyl)-2-oxo-3H-1-benzofuran-5-yl]propanoate
Also Known As: 2,3-Dihydro-3-(4-chlorophenyl)-alpha-methyl-2-oxo-5-benzofuranacetic acid methyl ester, 5-Benzofuranacetic acid, 2,3-dihydro-3-(4-chlorophenyl)-alpha-methyl-2-oxo-, methyl ester, methyl 2-[3-(4-chlorophenyl)-2-oxo-3H-1-benzofuran-5-yl]propanoate, Methyl 2-[3-(4-chlorophenyl)-2-oxo-2,3-dihydro-1-benzofuran-5-yl]propanoate, BRN 4528247
| Molecular Formula | C18H15ClO4 |
|---|---|
| Molecular Weight | 330.07 g/mol |
| LogP | 3.6674 |
| Topological Polar Surface Area | 52.6 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 3 |
| Exact Mass | 330.0659 |
| Heavy Atoms | 23 |
| Complexity | 767.0911 |
Chemical Identifiers
| CAS Number | 77143-65-8 |
|---|---|
| SMILES | CC(C1=CC2=C(C=C1)OC(=O)C2C3=CC=C(C=C3)Cl)C(=O)OC |
Product Overview
2,3-Dihydro-3-(4-chlorophenyl)-alpha-methyl-2-oxo-5-benzofuranacetic acid methyl ester (CAS 77143-65-8), with molecular formula C18H15ClO4 and molecular weight 330.07 g/mol. IUPAC: methyl 2-[3-(4-chlorophenyl)-2-oxo-3H-1-benzofuran-5-yl]propanoate.
Chemical Property Profile of 2,3-Dihydro-3-(4-chlorophenyl)-alpha-methyl-2-oxo-5-benzofuranacetic acid methyl ester
Property Insights of 2,3-Dihydro-3-(4-chlorophenyl)-alpha-methyl-2-oxo-5-benzofuranacetic acid methyl ester
The XLogP value of 3.6674 indicates that 2,3-Dihydro-3-(4-chlorophenyl)-alpha-methyl-2-oxo-5-benzofuranacetic acid 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, 2,3-Dihydro-3-(4-chlorophenyl)-alpha-methyl-2-oxo-5-benzofuranacetic acid methyl ester exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 2,3-Dihydro-3-(4-chlorophenyl)-alpha-methyl-2-oxo-5-benzofuranacetic 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 2,3-Dihydro-3-(4-chlorophenyl)-alpha-methyl-2-oxo-5-benzofuranacetic acid methyl ester?
The CAS number of 2,3-Dihydro-3-(4-chlorophenyl)-alpha-methyl-2-oxo-5-benzofuranacetic acid methyl ester is 77143-65-8.
What is the molecular formula of 2,3-Dihydro-3-(4-chlorophenyl)-alpha-methyl-2-oxo-5-benzofuranacetic acid methyl ester?
The molecular formula of 2,3-Dihydro-3-(4-chlorophenyl)-alpha-methyl-2-oxo-5-benzofuranacetic acid methyl ester is C18H15ClO4.
What is the molecular weight of 2,3-Dihydro-3-(4-chlorophenyl)-alpha-methyl-2-oxo-5-benzofuranacetic acid methyl ester?
The molecular weight of 2,3-Dihydro-3-(4-chlorophenyl)-alpha-methyl-2-oxo-5-benzofuranacetic acid methyl ester is 330.07 g/mol.
Where can I buy 2,3-Dihydro-3-(4-chlorophenyl)-alpha-methyl-2-oxo-5-benzofuranacetic acid methyl ester?
You can request a quote for 2,3-Dihydro-3-(4-chlorophenyl)-alpha-methyl-2-oxo-5-benzofuranacetic 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 2,3-Dihydro-3-(4-chlorophenyl)-alpha-methyl-2-oxo-5-benzofuranacetic acid methyl ester?
Yes, KEHONG BIO provides custom synthesis services for 2,3-Dihydro-3-(4-chlorophenyl)-alpha-methyl-2-oxo-5-benzofuranacetic acid methyl ester and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.