3-(4-Chlorophenyl)-2-phenyl-prop-2-enoic acid
TL;DR: 3-(4-Chlorophenyl)-2-phenyl-prop-2-enoic acid (CAS 7466-99-1) is a chemical compound with molecular formula C15H11ClO2 and molecular weight 258.04 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
3-(4-chlorophenyl)-2-phenylprop-2-enoic acid
Also Known As: 4-Di-N-Propylamino-1-Butanol, alpha-phenyl-4-chlorocinnamic acid, 3-(4-chlorophenyl)-2-phenyl-prop-2-enoic acid, 4-CHLORO-(alpha-PHENYL)-CINNAMIC ACID, 3-(4-chlorophenyl)-2-phenylprop-2-enoic acid
| Molecular Formula | C15H11ClO2 |
|---|---|
| Molecular Weight | 258.04 g/mol |
| LogP | 4.1 |
| Topological Polar Surface Area | 37.3 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 2 |
| Rotatable Bonds | 3 |
| Exact Mass | 258.04477 |
| Heavy Atoms | 18 |
| Complexity | 310.0 |
Chemical Identifiers
| CAS Number | 7466-99-1 |
|---|---|
| SMILES | C1=CC=C(C=C1)C(=CC2=CC=C(C=C2)Cl)C(=O)O |
| InChIKey | VRWKAXRIXMCDDY-UHFFFAOYSA-N |
Patent-Derived Application Labels
Derived from 3 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
3-(4-Chlorophenyl)-2-phenyl-prop-2-enoic acid (CAS 7466-99-1), with molecular formula C15H11ClO2 and molecular weight 258.04 g/mol. IUPAC: 3-(4-chlorophenyl)-2-phenylprop-2-enoic acid.
Chemical Property Profile of 3-(4-Chlorophenyl)-2-phenyl-prop-2-enoic acid
Property Insights of 3-(4-Chlorophenyl)-2-phenyl-prop-2-enoic acid
The XLogP value of 4.1 indicates that 3-(4-Chlorophenyl)-2-phenyl-prop-2-enoic 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, 3-(4-Chlorophenyl)-2-phenyl-prop-2-enoic acid exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 3-(4-Chlorophenyl)-2-phenyl-prop-2-enoic 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 3-(4-Chlorophenyl)-2-phenyl-prop-2-enoic acid?
The CAS number of 3-(4-Chlorophenyl)-2-phenyl-prop-2-enoic acid is 7466-99-1.
What is the molecular formula of 3-(4-Chlorophenyl)-2-phenyl-prop-2-enoic acid?
The molecular formula of 3-(4-Chlorophenyl)-2-phenyl-prop-2-enoic acid is C15H11ClO2.
What is the molecular weight of 3-(4-Chlorophenyl)-2-phenyl-prop-2-enoic acid?
The molecular weight of 3-(4-Chlorophenyl)-2-phenyl-prop-2-enoic acid is 258.04 g/mol.
Where can I buy 3-(4-Chlorophenyl)-2-phenyl-prop-2-enoic acid?
You can request a quote for 3-(4-Chlorophenyl)-2-phenyl-prop-2-enoic acid directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 3-(4-Chlorophenyl)-2-phenyl-prop-2-enoic acid?
Yes, KEHONG BIO provides custom synthesis services for 3-(4-Chlorophenyl)-2-phenyl-prop-2-enoic acid and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.