4-Chloro-2-methylphenoxyacetic acid, dimethyl(1-cyanoethyl)silyl ester
TL;DR: 4-Chloro-2-methylphenoxyacetic acid, dimethyl(1-cyanoethyl)silyl ester (CAS 106865-00-3) is a chemical compound with molecular formula C14H18ClNO3Si and molecular weight 311.07 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
[1-cyanoethyl(dimethyl)silyl] 2-(4-chloro-2-methylphenoxy)acetate
Also Known As: (1-Cyanoethyl)(dimethyl)silyl (4-chloro-2-methylphenoxy)acetate, (1-Cyanoethyl)(dimethyl)silyl (4-chloro-2-methylphenoxy)acetate #, [1-cyanoethyl(dimethyl)silyl] 2-(4-chloro-2-methylphenoxy)acetate, 4-Chloro-2-methylphenoxyacetic acid, dimethyl(1-cyanoethyl)silyl ester
| Molecular Formula | C14H18ClNO3Si |
|---|---|
| Molecular Weight | 311.07 g/mol |
| LogP | 3.6892 |
| Topological Polar Surface Area | 59.3 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 6 |
| Exact Mass | 311.07446 |
| Heavy Atoms | 20 |
| Complexity | 393.0 |
Chemical Identifiers
| CAS Number | 106865-00-3 |
|---|---|
| SMILES | CC1=C(C=CC(=C1)Cl)OCC(=O)O[Si](C)(C)C(C)C#N |
| InChIKey | WMUAJQWGLYHEPK-UHFFFAOYSA-N |
Product Overview
4-Chloro-2-methylphenoxyacetic acid, dimethyl(1-cyanoethyl)silyl ester (CAS 106865-00-3), with molecular formula C14H18ClNO3Si and molecular weight 311.07 g/mol. IUPAC: [1-cyanoethyl(dimethyl)silyl] 2-(4-chloro-2-methylphenoxy)acetate.
Chemical Property Profile of 4-Chloro-2-methylphenoxyacetic acid, dimethyl(1-cyanoethyl)silyl ester
Property Insights of 4-Chloro-2-methylphenoxyacetic acid, dimethyl(1-cyanoethyl)silyl ester
The XLogP value of 3.6892 indicates that 4-Chloro-2-methylphenoxyacetic acid, dimethyl(1-cyanoethyl)silyl ester is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 59.3 Ų, 4-Chloro-2-methylphenoxyacetic acid, dimethyl(1-cyanoethyl)silyl ester exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 4-Chloro-2-methylphenoxyacetic acid, dimethyl(1-cyanoethyl)silyl ester has 0 hydrogen bond donor(s) and 4 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 4-Chloro-2-methylphenoxyacetic acid, dimethyl(1-cyanoethyl)silyl ester?
The CAS number of 4-Chloro-2-methylphenoxyacetic acid, dimethyl(1-cyanoethyl)silyl ester is 106865-00-3.
What is the molecular formula of 4-Chloro-2-methylphenoxyacetic acid, dimethyl(1-cyanoethyl)silyl ester?
The molecular formula of 4-Chloro-2-methylphenoxyacetic acid, dimethyl(1-cyanoethyl)silyl ester is C14H18ClNO3Si.
What is the molecular weight of 4-Chloro-2-methylphenoxyacetic acid, dimethyl(1-cyanoethyl)silyl ester?
The molecular weight of 4-Chloro-2-methylphenoxyacetic acid, dimethyl(1-cyanoethyl)silyl ester is 311.07 g/mol.
Where can I buy 4-Chloro-2-methylphenoxyacetic acid, dimethyl(1-cyanoethyl)silyl ester?
You can request a quote for 4-Chloro-2-methylphenoxyacetic acid, dimethyl(1-cyanoethyl)silyl ester directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 4-Chloro-2-methylphenoxyacetic acid, dimethyl(1-cyanoethyl)silyl ester?
Yes, KEHONG BIO provides custom synthesis services for 4-Chloro-2-methylphenoxyacetic acid, dimethyl(1-cyanoethyl)silyl ester and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.