3-Phenoxycinnamic acid
TL;DR: 3-Phenoxycinnamic acid (CAS 83106-03-0) is a chemical compound with molecular formula C15H12O3 and molecular weight 240.08 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
(E)-3-(3-phenoxyphenyl)prop-2-enoic acid
Also Known As: 3-Phenoxycinnamic acid, trans-3-Phenoxycinnamic acid, 3-(3-phenoxyphenyl)acrylic acid, trans-3-Phenoxycinnamicacid, (E)-3-(3-phenoxyphenyl)prop-2-enoic acid
| Molecular Formula | C15H12O3 |
|---|---|
| Molecular Weight | 240.08 g/mol |
| LogP | 3.4 |
| Topological Polar Surface Area | 46.5 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 4 |
| Exact Mass | 240.07864 |
| Heavy Atoms | 18 |
| Complexity | 292.0 |
Chemical Identifiers
| CAS Number | 83106-03-0 |
|---|---|
| SMILES | C1=CC=C(C=C1)OC2=CC=CC(=C2)/C=C/C(=O)O |
| InChIKey | RYTBBLWPDBZDHT-MDZDMXLPSA-N |
Patent-Derived Application Labels
Derived from 6 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
3-Phenoxycinnamic acid (CAS 83106-03-0), with molecular formula C15H12O3 and molecular weight 240.08 g/mol. IUPAC: (E)-3-(3-phenoxyphenyl)prop-2-enoic acid.
Chemical Property Profile of 3-Phenoxycinnamic acid
Property Insights of 3-Phenoxycinnamic acid
The XLogP value of 3.4 indicates that 3-Phenoxycinnamic 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, 3-Phenoxycinnamic acid exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 3-Phenoxycinnamic acid has 1 hydrogen bond donor(s) and 3 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-Phenoxycinnamic acid?
The CAS number of 3-Phenoxycinnamic acid is 83106-03-0.
What is the molecular formula of 3-Phenoxycinnamic acid?
The molecular formula of 3-Phenoxycinnamic acid is C15H12O3.
What is the molecular weight of 3-Phenoxycinnamic acid?
The molecular weight of 3-Phenoxycinnamic acid is 240.08 g/mol.
Where can I buy 3-Phenoxycinnamic acid?
You can request a quote for 3-Phenoxycinnamic acid directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 3-Phenoxycinnamic acid?
Yes, KEHONG BIO provides custom synthesis services for 3-Phenoxycinnamic acid and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.