Methyl 2-(2-(2-Chloro-4-(2-methylheptan-2-yl)phenoxy)ethoxy)acetate
TL;DR: Methyl 2-(2-(2-Chloro-4-(2-methylheptan-2-yl)phenoxy)ethoxy)acetate (CAS 100345-03-7) is a chemical compound with molecular formula C19H29ClO4 and molecular weight 356.18 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
methyl 2-[2-[2-chloro-4-(2-methylheptan-2-yl)phenoxy]ethoxy]acetate
Also Known As: Methyl 2-(2-(2-Chloro-4-(2-methylheptan-2-yl)phenoxy)ethoxy)acetate, Methyl 2-[2-[2-chloro-4-(2-methylheptan-2-yl)phenoxy]ethoxy]acetate, methyl {2-[2-chloro-4-(2-methylheptan-2-yl)phenoxy]ethoxy}acetate, RefChem:353784
| Molecular Formula | C19H29ClO4 |
|---|---|
| Molecular Weight | 356.18 g/mol |
| LogP | 6.1 |
| Topological Polar Surface Area | 44.8 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 12 |
| Exact Mass | 356.17545 |
| Heavy Atoms | 24 |
| Complexity | 359.0 |
Chemical Identifiers
| CAS Number | 100345-03-7 |
|---|---|
| SMILES | CCCCCC(C)(C)C1=CC(=C(C=C1)OCCOCC(=O)OC)Cl |
| InChIKey | AFCHSIBEYJBYET-UHFFFAOYSA-N |
Product Overview
Methyl 2-(2-(2-Chloro-4-(2-methylheptan-2-yl)phenoxy)ethoxy)acetate (CAS 100345-03-7), with molecular formula C19H29ClO4 and molecular weight 356.18 g/mol. IUPAC: methyl 2-[2-[2-chloro-4-(2-methylheptan-2-yl)phenoxy]ethoxy]acetate.
Chemical Property Profile of Methyl 2-(2-(2-Chloro-4-(2-methylheptan-2-yl)phenoxy)ethoxy)acetate
Property Insights of Methyl 2-(2-(2-Chloro-4-(2-methylheptan-2-yl)phenoxy)ethoxy)acetate
The XLogP value of 6.1 indicates that Methyl 2-(2-(2-Chloro-4-(2-methylheptan-2-yl)phenoxy)ethoxy)acetate is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 44.8 Ų, Methyl 2-(2-(2-Chloro-4-(2-methylheptan-2-yl)phenoxy)ethoxy)acetate exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, Methyl 2-(2-(2-Chloro-4-(2-methylheptan-2-yl)phenoxy)ethoxy)acetate has 0 hydrogen bond donor(s) and 4 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of Methyl 2-(2-(2-Chloro-4-(2-methylheptan-2-yl)phenoxy)ethoxy)acetate?
The CAS number of Methyl 2-(2-(2-Chloro-4-(2-methylheptan-2-yl)phenoxy)ethoxy)acetate is 100345-03-7.
What is the molecular formula of Methyl 2-(2-(2-Chloro-4-(2-methylheptan-2-yl)phenoxy)ethoxy)acetate?
The molecular formula of Methyl 2-(2-(2-Chloro-4-(2-methylheptan-2-yl)phenoxy)ethoxy)acetate is C19H29ClO4.
What is the molecular weight of Methyl 2-(2-(2-Chloro-4-(2-methylheptan-2-yl)phenoxy)ethoxy)acetate?
The molecular weight of Methyl 2-(2-(2-Chloro-4-(2-methylheptan-2-yl)phenoxy)ethoxy)acetate is 356.18 g/mol.
Where can I buy Methyl 2-(2-(2-Chloro-4-(2-methylheptan-2-yl)phenoxy)ethoxy)acetate?
You can request a quote for Methyl 2-(2-(2-Chloro-4-(2-methylheptan-2-yl)phenoxy)ethoxy)acetate directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Methyl 2-(2-(2-Chloro-4-(2-methylheptan-2-yl)phenoxy)ethoxy)acetate?
Yes, KEHONG BIO provides custom synthesis services for Methyl 2-(2-(2-Chloro-4-(2-methylheptan-2-yl)phenoxy)ethoxy)acetate and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.