Propan-2-yl 2-(4-chlorophenoxy)acetate
TL;DR: Propan-2-yl 2-(4-chlorophenoxy)acetate (CAS 41944-93-8) is a chemical compound with molecular formula C11H13ClO3 and molecular weight 228.06 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
propan-2-yl 2-(4-chlorophenoxy)acetate
Also Known As: propan-2-yl 2-(4-chlorophenoxy)acetate, Meclofenoxate Impurity 10, Meclofenoxate Hcl Impurity 6, propan-2-yl (4-chlorophenoxy)acetate, methylethyl 2-(4-chlorophenoxy)acetate
| Molecular Formula | C11H13ClO3 |
|---|---|
| Molecular Weight | 228.06 g/mol |
| LogP | 3.4 |
| Topological Polar Surface Area | 35.5 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 5 |
| Exact Mass | 228.05533 |
| Heavy Atoms | 15 |
| Complexity | 198.0 |
Chemical Identifiers
| CAS Number | 41944-93-8 |
|---|---|
| SMILES | CC(C)OC(=O)COC1=CC=C(C=C1)Cl |
| InChIKey | RDUMUXSLQNRSAF-UHFFFAOYSA-N |
Product Overview
Propan-2-yl 2-(4-chlorophenoxy)acetate (CAS 41944-93-8), with molecular formula C11H13ClO3 and molecular weight 228.06 g/mol. IUPAC: propan-2-yl 2-(4-chlorophenoxy)acetate.
Chemical Property Profile of Propan-2-yl 2-(4-chlorophenoxy)acetate
Property Insights of Propan-2-yl 2-(4-chlorophenoxy)acetate
The XLogP value of 3.4 indicates that Propan-2-yl 2-(4-chlorophenoxy)acetate is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 35.5 Ų, Propan-2-yl 2-(4-chlorophenoxy)acetate exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, Propan-2-yl 2-(4-chlorophenoxy)acetate has 0 hydrogen bond donor(s) and 3 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 Propan-2-yl 2-(4-chlorophenoxy)acetate?
The CAS number of Propan-2-yl 2-(4-chlorophenoxy)acetate is 41944-93-8.
What is the molecular formula of Propan-2-yl 2-(4-chlorophenoxy)acetate?
The molecular formula of Propan-2-yl 2-(4-chlorophenoxy)acetate is C11H13ClO3.
What is the molecular weight of Propan-2-yl 2-(4-chlorophenoxy)acetate?
The molecular weight of Propan-2-yl 2-(4-chlorophenoxy)acetate is 228.06 g/mol.
Where can I buy Propan-2-yl 2-(4-chlorophenoxy)acetate?
You can request a quote for Propan-2-yl 2-(4-chlorophenoxy)acetate directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Propan-2-yl 2-(4-chlorophenoxy)acetate?
Yes, KEHONG BIO provides custom synthesis services for Propan-2-yl 2-(4-chlorophenoxy)acetate and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.