4-(Heptyloxy)cinnamic acid
TL;DR: 4-(Heptyloxy)cinnamic acid (CAS 62718-64-3) is a chemical compound with molecular formula C16H22O3 and molecular weight 262.16 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
3-(4-heptoxyphenyl)prop-2-enoic acid
Also Known As: 4-heptyloxycinnamic acid, 4-(HEPTYLOXY)CINNAMIC ACID, 3-(4-heptoxyphenyl)prop-2-enoic acid, BAS 01123481, 3-[4-(Heptyloxy)phenyl]-2-propenoic acid
| Molecular Formula | C16H22O3 |
|---|---|
| Molecular Weight | 262.16 g/mol |
| LogP | 4.1336 |
| Topological Polar Surface Area | 46.53 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 2 |
| Rotatable Bonds | 9 |
| Exact Mass | 262.1569 |
| Heavy Atoms | 19 |
| Complexity | 392.96 |
Chemical Identifiers
| CAS Number | 62718-64-3 |
|---|---|
| SMILES | CCCCCCCOC1=CC=C(C=C1)C=CC(=O)O |
Product Overview
4-(Heptyloxy)cinnamic acid (CAS 62718-64-3), with molecular formula C16H22O3 and molecular weight 262.16 g/mol. IUPAC: 3-(4-heptoxyphenyl)prop-2-enoic acid.
Chemical Property Profile of 4-(Heptyloxy)cinnamic acid
Property Insights of 4-(Heptyloxy)cinnamic acid
The XLogP value of 4.1336 indicates that 4-(Heptyloxy)cinnamic acid is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 46.53 Ų, 4-(Heptyloxy)cinnamic acid exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 4-(Heptyloxy)cinnamic 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 4-(Heptyloxy)cinnamic acid?
The CAS number of 4-(Heptyloxy)cinnamic acid is 62718-64-3.
What is the molecular formula of 4-(Heptyloxy)cinnamic acid?
The molecular formula of 4-(Heptyloxy)cinnamic acid is C16H22O3.
What is the molecular weight of 4-(Heptyloxy)cinnamic acid?
The molecular weight of 4-(Heptyloxy)cinnamic acid is 262.16 g/mol.
Where can I buy 4-(Heptyloxy)cinnamic acid?
You can request a quote for 4-(Heptyloxy)cinnamic acid directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 4-(Heptyloxy)cinnamic acid?
Yes, KEHONG BIO provides custom synthesis services for 4-(Heptyloxy)cinnamic acid and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.