4-Acetoxycinnamic acid
TL;DR: 4-Acetoxycinnamic acid (CAS 15745-04-7) is a chemical compound with molecular formula C11H10O4 and molecular weight 206.06 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
(E)-3-(4-acetyloxyphenyl)prop-2-enoic acid
Also Known As: 4-Acetoxycinnamic acid, p-Acetoxycinnamic acid, acetylated coumaric acid, trans-4-Acetoxycinnamic acid, 3-(4-ACETOXYPHENYL)ACRYLIC ACID
| Molecular Formula | C11H10O4 |
|---|---|
| Molecular Weight | 206.06 g/mol |
| LogP | 1.7097 |
| Topological Polar Surface Area | 63.6 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 3 |
| Exact Mass | 206.0579 |
| Heavy Atoms | 15 |
| Complexity | 389.55386 |
Chemical Identifiers
| CAS Number | 15745-04-7 |
|---|---|
| SMILES | CC(=O)OC1=CC=C(C=C1)/C=C/C(=O)O |
Product Overview
4-Acetoxycinnamic acid (CAS 15745-04-7), with molecular formula C11H10O4 and molecular weight 206.06 g/mol. IUPAC: (E)-3-(4-acetyloxyphenyl)prop-2-enoic acid.
Chemical Property Profile of 4-Acetoxycinnamic acid
Property Insights of 4-Acetoxycinnamic acid
The XLogP value of 1.7097 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 4-Acetoxycinnamic acid. The TPSA of 63.6 Ų falls within the moderate polarity range, balancing permeability and solubility for 4-Acetoxycinnamic acid. Following Lipinski's Rule of Five, 4-Acetoxycinnamic 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 4-Acetoxycinnamic acid?
The CAS number of 4-Acetoxycinnamic acid is 15745-04-7.
What is the molecular formula of 4-Acetoxycinnamic acid?
The molecular formula of 4-Acetoxycinnamic acid is C11H10O4.
What is the molecular weight of 4-Acetoxycinnamic acid?
The molecular weight of 4-Acetoxycinnamic acid is 206.06 g/mol.
Where can I buy 4-Acetoxycinnamic acid?
You can request a quote for 4-Acetoxycinnamic acid directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 4-Acetoxycinnamic acid?
Yes, KEHONG BIO provides custom synthesis services for 4-Acetoxycinnamic acid and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.