Octylcinnamate
TL;DR: Octylcinnamate (CAS 69038-78-4) is a chemical compound with molecular formula C17H24O2 and molecular weight 260.18 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
octyl 3-phenylprop-2-enoate
Also Known As: Octyl cinnamate, n-Octyl cinnamate, OCTYLCINNAMATE, octyl 3-phenylprop-2-enoate, 2-Propenoic acid,3-phenyl-, octyl ester
| Molecular Formula | C17H24O2 |
|---|---|
| Molecular Weight | 260.18 g/mol |
| LogP | 4.6035 |
| Topological Polar Surface Area | 26.3 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 2 |
| Rotatable Bonds | 9 |
| Exact Mass | 260.17764 |
| Heavy Atoms | 19 |
| Complexity | 368.10828 |
Chemical Identifiers
| CAS Number | 69038-78-4 |
|---|---|
| SMILES | CCCCCCCCOC(=O)C=CC1=CC=CC=C1 |
Product Overview
Octylcinnamate (CAS 69038-78-4), with molecular formula C17H24O2 and molecular weight 260.18 g/mol. IUPAC: octyl 3-phenylprop-2-enoate.
Chemical Property Profile of Octylcinnamate
Property Insights of Octylcinnamate
The XLogP value of 4.6035 indicates that Octylcinnamate is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 26.3 Ų, Octylcinnamate exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, Octylcinnamate has 0 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 Octylcinnamate?
The CAS number of Octylcinnamate is 69038-78-4.
What is the molecular formula of Octylcinnamate?
The molecular formula of Octylcinnamate is C17H24O2.
What is the molecular weight of Octylcinnamate?
The molecular weight of Octylcinnamate is 260.18 g/mol.
Where can I buy Octylcinnamate?
You can request a quote for Octylcinnamate directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Octylcinnamate?
Yes, KEHONG BIO provides custom synthesis services for Octylcinnamate and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.