2-(4-Chlorophenyl)-3-phenylpropanoic acid
TL;DR: 2-(4-Chlorophenyl)-3-phenylpropanoic acid (CAS 787-27-9) is a chemical compound with molecular formula C15H13ClO2 and molecular weight 260.06 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2-(4-chlorophenyl)-3-phenylpropanoic acid
Also Known As: 2-(4-chlorophenyl)-3-phenylpropanoic acid, starbld0024470, 2-(4-chlorophenyl)-3-phenylpropanoicacid, 2-(4-chlorophenyl)-3-phenyl-propanoic acid, 2-(4-Chloro-phenyl)-3-phenyl-propionic acid
| Molecular Formula | C15H13ClO2 |
|---|---|
| Molecular Weight | 260.06 g/mol |
| LogP | 4.0 |
| Topological Polar Surface Area | 37.3 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 2 |
| Rotatable Bonds | 4 |
| Exact Mass | 260.0604 |
| Heavy Atoms | 18 |
| Complexity | 266.0 |
Chemical Identifiers
| CAS Number | 787-27-9 |
|---|---|
| SMILES | C1=CC=C(C=C1)CC(C2=CC=C(C=C2)Cl)C(=O)O |
| InChIKey | CUMMKZITYCLISM-UHFFFAOYSA-N |
Patent-Derived Application Labels
Derived from 3 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
2-(4-Chlorophenyl)-3-phenylpropanoic acid (CAS 787-27-9), with molecular formula C15H13ClO2 and molecular weight 260.06 g/mol. IUPAC: 2-(4-chlorophenyl)-3-phenylpropanoic acid.
Chemical Property Profile of 2-(4-Chlorophenyl)-3-phenylpropanoic acid
Property Insights of 2-(4-Chlorophenyl)-3-phenylpropanoic acid
The XLogP value of 4.0 indicates that 2-(4-Chlorophenyl)-3-phenylpropanoic acid is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 37.3 Ų, 2-(4-Chlorophenyl)-3-phenylpropanoic acid exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 2-(4-Chlorophenyl)-3-phenylpropanoic acid has 1 hydrogen bond donor(s) and 2 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-(4-Chlorophenyl)-3-phenylpropanoic acid?
The CAS number of 2-(4-Chlorophenyl)-3-phenylpropanoic acid is 787-27-9.
What is the molecular formula of 2-(4-Chlorophenyl)-3-phenylpropanoic acid?
The molecular formula of 2-(4-Chlorophenyl)-3-phenylpropanoic acid is C15H13ClO2.
What is the molecular weight of 2-(4-Chlorophenyl)-3-phenylpropanoic acid?
The molecular weight of 2-(4-Chlorophenyl)-3-phenylpropanoic acid is 260.06 g/mol.
Where can I buy 2-(4-Chlorophenyl)-3-phenylpropanoic acid?
You can request a quote for 2-(4-Chlorophenyl)-3-phenylpropanoic acid directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 2-(4-Chlorophenyl)-3-phenylpropanoic acid?
Yes, KEHONG BIO provides custom synthesis services for 2-(4-Chlorophenyl)-3-phenylpropanoic acid and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.