RefChem:1100647
TL;DR: RefChem:1100647 (CAS 84006-40-6) is a chemical compound with molecular formula C25H38O5 and molecular weight 418.27 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
3-[(E)-3-(4-methoxyphenyl)prop-2-enoyl]oxybutan-2-yl undecanoate
Also Known As: 2-(3-(4-Methoxyphenyl-1-oxo-2-propenyl)oxy)-1-methylpropyl undecanoate, Undecanoic acid, 2-((3-(4-methoxyphenyl-1-oxo-2-propenyl)oxy)-1-methylpropyl ester, 3-[(E)-3-(4-methoxyphenyl)prop-2-enoyl]oxybutan-2-yl undecanoate, RefChem:1100647
| Molecular Formula | C25H38O5 |
|---|---|
| Molecular Weight | 418.27 g/mol |
| LogP | 6.1026 |
| Topological Polar Surface Area | 61.83 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 15 |
| Exact Mass | 418.2719 |
| Heavy Atoms | 30 |
| Complexity | 635.444 |
Chemical Identifiers
| CAS Number | 84006-40-6 |
|---|---|
| SMILES | CCCCCCCCCCC(=O)OC(C)C(C)OC(=O)/C=C/C1=CC=C(C=C1)OC |
Product Overview
RefChem:1100647 (CAS 84006-40-6), with molecular formula C25H38O5 and molecular weight 418.27 g/mol. IUPAC: 3-[(E)-3-(4-methoxyphenyl)prop-2-enoyl]oxybutan-2-yl undecanoate.
Chemical Property Profile of RefChem:1100647
Property Insights of RefChem:1100647
The XLogP value of 6.1026 indicates that RefChem:1100647 is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 61.83 Ų falls within the moderate polarity range, balancing permeability and solubility for RefChem:1100647. Following Lipinski's Rule of Five, RefChem:1100647 has 0 hydrogen bond donor(s) and 5 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of RefChem:1100647?
The CAS number of RefChem:1100647 is 84006-40-6.
What is the molecular formula of RefChem:1100647?
The molecular formula of RefChem:1100647 is C25H38O5.
What is the molecular weight of RefChem:1100647?
The molecular weight of RefChem:1100647 is 418.27 g/mol.
Where can I buy RefChem:1100647?
You can request a quote for RefChem:1100647 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for RefChem:1100647?
Yes, KEHONG BIO provides custom synthesis services for RefChem:1100647 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.