2-(4-Methylphenoxy)-7-(4-chlorophenyl)heptanoic acid
TL;DR: 2-(4-Methylphenoxy)-7-(4-chlorophenyl)heptanoic acid (CAS 145096-04-4) is a chemical compound with molecular formula C20H23ClO3 and molecular weight 346.13358 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
7-(4-chlorophenyl)-2-(4-methylphenoxy)heptanoic acid
Also Known As: 2- -7- heptanoicacid, 2-(4-Methylphenoxy)-7-(4-chlorophenyl)heptanoic acid, BM 13.0913, 7-(4-chlorophenyl)-2-(4-methylphenoxy)heptanoic acid, BM 130913
Application Areas
Top 5 of 3 IPC patent classification(s) from the SureChEMBL global patent database.
Technical Specifications
| Molecular Formula | C20H23ClO3 |
| Molecular Weight | 346.13358 g/mol |
| XLogP | 6.3 |
| Topological Polar Surface Area (TPSA) | 46.5 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 9 |
| Exact Mass | 346.13358 Da |
| Heavy Atoms | 24 |
| Complexity | 358.0 |
| SMILES | CC1=CC=C(C=C1)OC(CCCCCC2=CC=C(C=C2)Cl)C(=O)O |
| InChIKey | DDDYMWYRGWBBNA-UHFFFAOYSA-N |
Chemical Property Profile of 2-(4-Methylphenoxy)-7-(4-chlorophenyl)heptanoic acid
Property Insights of 2-(4-Methylphenoxy)-7-(4-chlorophenyl)heptanoic acid
The XLogP value of 6.3 indicates that 2-(4-Methylphenoxy)-7-(4-chlorophenyl)heptanoic acid is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 46.5 Ų, 2-(4-Methylphenoxy)-7-(4-chlorophenyl)heptanoic acid exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 2-(4-Methylphenoxy)-7-(4-chlorophenyl)heptanoic acid has 1 hydrogen bond donor(s) and 3 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
Frequently Asked Questions
What is the CAS number of 2-(4-Methylphenoxy)-7-(4-chlorophenyl)heptanoic acid?
The CAS number of 2-(4-Methylphenoxy)-7-(4-chlorophenyl)heptanoic acid is 145096-04-4.
What is the molecular formula of 2-(4-Methylphenoxy)-7-(4-chlorophenyl)heptanoic acid?
The molecular formula of 2-(4-Methylphenoxy)-7-(4-chlorophenyl)heptanoic acid is C20H23ClO3.
What is the molecular weight of 2-(4-Methylphenoxy)-7-(4-chlorophenyl)heptanoic acid?
The molecular weight of 2-(4-Methylphenoxy)-7-(4-chlorophenyl)heptanoic acid is 346.13358 g/mol.
Where can I buy 2-(4-Methylphenoxy)-7-(4-chlorophenyl)heptanoic acid?
You can request a quote for 2-(4-Methylphenoxy)-7-(4-chlorophenyl)heptanoic acid directly from CoreyChem. Contact us or email [email protected] for pricing and availability.
Does CoreyChem offer custom synthesis for 2-(4-Methylphenoxy)-7-(4-chlorophenyl)heptanoic acid?
Yes, CoreyChem provides custom synthesis services for 2-(4-Methylphenoxy)-7-(4-chlorophenyl)heptanoic acid and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.