Propanoic Acid, 2-(4-chloro-2-methylphenoxy)-, (1-cyanoethyl)dimethylsilyl Ester
TL;DR: Propanoic Acid, 2-(4-chloro-2-methylphenoxy)-, (1-cyanoethyl)dimethylsilyl Ester (CAS 106864-97-5) is a chemical compound with molecular formula C15H20ClNO3Si and molecular weight 325.09 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)propanoate
Also Known As: KST-1A0768, (1-cyanoethyl)(dimethyl)silyl 2-(4-chloro-2-methylphenoxy)propanoate, Propanoic Acid, 2-(4-chloro-2-methylphenoxy)-, (1-cyanoethyl)dimethylsilyl Ester, (1-Cyanoethyl-dimethylsilyl) 2-(4-chloro-2-methylphenoxy)propanoate, Propanoicacid, 2-(4-chloro-2-methylphenoxy)-, (1-cyanoethyl)dimethylsilyl ester
| Molecular Formula | C15H20ClNO3Si |
|---|---|
| Molecular Weight | 325.09 g/mol |
| LogP | 4.0777 |
| Topological Polar Surface Area | 59.3 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 6 |
| Exact Mass | 325.0901 |
| Heavy Atoms | 21 |
| Complexity | 420.0 |
Chemical Identifiers
| CAS Number | 106864-97-5 |
|---|---|
| SMILES | CC1=C(C=CC(=C1)Cl)OC(C)C(=O)O[Si](C)(C)C(C)C#N |
| InChIKey | ONZYFVHPDYHMSI-UHFFFAOYSA-N |
Product Overview
Propanoic Acid, 2-(4-chloro-2-methylphenoxy)-, (1-cyanoethyl)dimethylsilyl Ester (CAS 106864-97-5), with molecular formula C15H20ClNO3Si and molecular weight 325.09 g/mol. IUPAC: [1-cyanoethyl(dimethyl)silyl] 2-(4-chloro-2-methylphenoxy)propanoate.
Chemical Property Profile of Propanoic Acid, 2-(4-chloro-2-methylphenoxy)-, (1-cyanoethyl)dimethylsilyl Ester
Property Insights of Propanoic Acid, 2-(4-chloro-2-methylphenoxy)-, (1-cyanoethyl)dimethylsilyl Ester
The XLogP value of 4.0777 indicates that Propanoic Acid, 2-(4-chloro-2-methylphenoxy)-, (1-cyanoethyl)dimethylsilyl 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, Propanoic Acid, 2-(4-chloro-2-methylphenoxy)-, (1-cyanoethyl)dimethylsilyl Ester exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, Propanoic Acid, 2-(4-chloro-2-methylphenoxy)-, (1-cyanoethyl)dimethylsilyl 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 Propanoic Acid, 2-(4-chloro-2-methylphenoxy)-, (1-cyanoethyl)dimethylsilyl Ester?
The CAS number of Propanoic Acid, 2-(4-chloro-2-methylphenoxy)-, (1-cyanoethyl)dimethylsilyl Ester is 106864-97-5.
What is the molecular formula of Propanoic Acid, 2-(4-chloro-2-methylphenoxy)-, (1-cyanoethyl)dimethylsilyl Ester?
The molecular formula of Propanoic Acid, 2-(4-chloro-2-methylphenoxy)-, (1-cyanoethyl)dimethylsilyl Ester is C15H20ClNO3Si.
What is the molecular weight of Propanoic Acid, 2-(4-chloro-2-methylphenoxy)-, (1-cyanoethyl)dimethylsilyl Ester?
The molecular weight of Propanoic Acid, 2-(4-chloro-2-methylphenoxy)-, (1-cyanoethyl)dimethylsilyl Ester is 325.09 g/mol.
Where can I buy Propanoic Acid, 2-(4-chloro-2-methylphenoxy)-, (1-cyanoethyl)dimethylsilyl Ester?
You can request a quote for Propanoic Acid, 2-(4-chloro-2-methylphenoxy)-, (1-cyanoethyl)dimethylsilyl Ester directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Propanoic Acid, 2-(4-chloro-2-methylphenoxy)-, (1-cyanoethyl)dimethylsilyl Ester?
Yes, KEHONG BIO provides custom synthesis services for Propanoic Acid, 2-(4-chloro-2-methylphenoxy)-, (1-cyanoethyl)dimethylsilyl Ester and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.