4-(2-Methylbutyl)phenyl 3-[4-(hexyloxy)phenyl]-2-propenoate
TL;DR: 4-(2-Methylbutyl)phenyl 3-[4-(hexyloxy)phenyl]-2-propenoate (CAS 477860-02-9) is a chemical compound with molecular formula C26H34O3 and molecular weight 394.25 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
[4-(2-methylbutyl)phenyl] 3-(4-hexoxyphenyl)prop-2-enoate
Also Known As: Bionet1_003317, 4-(2-methylbutyl)phenyl (E)-3-[4-(hexyloxy)phenyl]-2-propenoate, [4-(2-methylbutyl)phenyl] 3-(4-hexoxyphenyl)prop-2-enoate, 4-(2-Methylbutyl)phenyl 3-[4-(hexyloxy)phenyl]-2-propenoate, 4-(2-Methylbutyl)phenyl 3-[4-(hexyloxy)phenyl]prop-2-enoate
| Molecular Formula | C26H34O3 |
|---|---|
| Molecular Weight | 394.25 g/mol |
| LogP | 6.8531 |
| Topological Polar Surface Area | 35.53 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 12 |
| Exact Mass | 394.2508 |
| Heavy Atoms | 29 |
| Complexity | 744.52783 |
Chemical Identifiers
| CAS Number | 477860-02-9 |
|---|---|
| SMILES | CCCCCCOC1=CC=C(C=C1)C=CC(=O)OC2=CC=C(C=C2)CC(C)CC |
Product Overview
4-(2-Methylbutyl)phenyl 3-[4-(hexyloxy)phenyl]-2-propenoate (CAS 477860-02-9), with molecular formula C26H34O3 and molecular weight 394.25 g/mol. IUPAC: [4-(2-methylbutyl)phenyl] 3-(4-hexoxyphenyl)prop-2-enoate.
Chemical Property Profile of 4-(2-Methylbutyl)phenyl 3-[4-(hexyloxy)phenyl]-2-propenoate
Property Insights of 4-(2-Methylbutyl)phenyl 3-[4-(hexyloxy)phenyl]-2-propenoate
The XLogP value of 6.8531 indicates that 4-(2-Methylbutyl)phenyl 3-[4-(hexyloxy)phenyl]-2-propenoate is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 35.53 Ų, 4-(2-Methylbutyl)phenyl 3-[4-(hexyloxy)phenyl]-2-propenoate exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 4-(2-Methylbutyl)phenyl 3-[4-(hexyloxy)phenyl]-2-propenoate has 0 hydrogen bond donor(s) and 3 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of 4-(2-Methylbutyl)phenyl 3-[4-(hexyloxy)phenyl]-2-propenoate?
The CAS number of 4-(2-Methylbutyl)phenyl 3-[4-(hexyloxy)phenyl]-2-propenoate is 477860-02-9.
What is the molecular formula of 4-(2-Methylbutyl)phenyl 3-[4-(hexyloxy)phenyl]-2-propenoate?
The molecular formula of 4-(2-Methylbutyl)phenyl 3-[4-(hexyloxy)phenyl]-2-propenoate is C26H34O3.
What is the molecular weight of 4-(2-Methylbutyl)phenyl 3-[4-(hexyloxy)phenyl]-2-propenoate?
The molecular weight of 4-(2-Methylbutyl)phenyl 3-[4-(hexyloxy)phenyl]-2-propenoate is 394.25 g/mol.
Where can I buy 4-(2-Methylbutyl)phenyl 3-[4-(hexyloxy)phenyl]-2-propenoate?
You can request a quote for 4-(2-Methylbutyl)phenyl 3-[4-(hexyloxy)phenyl]-2-propenoate directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 4-(2-Methylbutyl)phenyl 3-[4-(hexyloxy)phenyl]-2-propenoate?
Yes, KEHONG BIO provides custom synthesis services for 4-(2-Methylbutyl)phenyl 3-[4-(hexyloxy)phenyl]-2-propenoate and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.