![Methyl 3-[4-(octyloxy)phenyl]prop-2-enoate structure](/static/products/991/99196-57-3.png)
Methyl 3-[4-(octyloxy)phenyl]prop-2-enoate
TL;DR: Methyl 3-[4-(octyloxy)phenyl]prop-2-enoate (CAS 99196-57-3) is a chemical compound with molecular formula C18H26O3 and molecular weight 290.19 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
methyl 3-(4-octoxyphenyl)prop-2-enoate
Also Known As: Methyl 3-(4-octoxyphenyl)prop-2-enoate, methyl 3-[4-(octyloxy)phenyl]prop-2-enoate, methyl (E)-3-[4-(octyloxy)phenyl]-2-propenoate
| Molecular Formula | C18H26O3 |
|---|---|
| Molecular Weight | 290.19 g/mol |
| LogP | 4.6121 |
| Topological Polar Surface Area | 35.53 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 10 |
| Exact Mass | 290.1882 |
| Heavy Atoms | 21 |
| Complexity | 420.5945 |
Chemical Identifiers
| CAS Number | 99196-57-3 |
|---|---|
| SMILES | CCCCCCCCOC1=CC=C(C=C1)C=CC(=O)OC |
Product Overview
Methyl 3-[4-(octyloxy)phenyl]prop-2-enoate (CAS 99196-57-3), with molecular formula C18H26O3 and molecular weight 290.19 g/mol. IUPAC: methyl 3-(4-octoxyphenyl)prop-2-enoate.
Chemical Property Profile of Methyl 3-[4-(octyloxy)phenyl]prop-2-enoate
Property Insights of Methyl 3-[4-(octyloxy)phenyl]prop-2-enoate
The XLogP value of 4.6121 indicates that Methyl 3-[4-(octyloxy)phenyl]prop-2-enoate is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 35.53 Ų, Methyl 3-[4-(octyloxy)phenyl]prop-2-enoate exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, Methyl 3-[4-(octyloxy)phenyl]prop-2-enoate has 0 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 Methyl 3-[4-(octyloxy)phenyl]prop-2-enoate?
The CAS number of Methyl 3-[4-(octyloxy)phenyl]prop-2-enoate is 99196-57-3.
What is the molecular formula of Methyl 3-[4-(octyloxy)phenyl]prop-2-enoate?
The molecular formula of Methyl 3-[4-(octyloxy)phenyl]prop-2-enoate is C18H26O3.
What is the molecular weight of Methyl 3-[4-(octyloxy)phenyl]prop-2-enoate?
The molecular weight of Methyl 3-[4-(octyloxy)phenyl]prop-2-enoate is 290.19 g/mol.
Where can I buy Methyl 3-[4-(octyloxy)phenyl]prop-2-enoate?
You can request a quote for Methyl 3-[4-(octyloxy)phenyl]prop-2-enoate directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Methyl 3-[4-(octyloxy)phenyl]prop-2-enoate?
Yes, KEHONG BIO provides custom synthesis services for Methyl 3-[4-(octyloxy)phenyl]prop-2-enoate and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.