(2-Oxo-2-pyrrolidin-1-ylethyl) 2,3,6-trichlorobenzoate
TL;DR: (2-Oxo-2-pyrrolidin-1-ylethyl) 2,3,6-trichlorobenzoate (CAS 721892-93-9) is a chemical compound with molecular formula C13H12Cl3NO3 and molecular weight 334.99 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
(2-oxo-2-pyrrolidin-1-ylethyl) 2,3,6-trichlorobenzoate
Also Known As: (2-oxo-2-pyrrolidin-1-ylethyl) 2,3,6-trichlorobenzoate, 2-oxo-2-(pyrrolidin-1-yl)ethyl 2,3,6-trichlorobenzoate
| Molecular Formula | C13H12Cl3NO3 |
|---|---|
| Molecular Weight | 334.99 g/mol |
| LogP | 3.426 |
| Topological Polar Surface Area | 46.61 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 3 |
| Exact Mass | 334.98828 |
| Heavy Atoms | 20 |
| Complexity | 541.9081 |
Chemical Identifiers
| CAS Number | 721892-93-9 |
|---|---|
| SMILES | C1CCN(C1)C(=O)COC(=O)C2=C(C=CC(=C2Cl)Cl)Cl |
Product Overview
(2-Oxo-2-pyrrolidin-1-ylethyl) 2,3,6-trichlorobenzoate (CAS 721892-93-9), with molecular formula C13H12Cl3NO3 and molecular weight 334.99 g/mol. IUPAC: (2-oxo-2-pyrrolidin-1-ylethyl) 2,3,6-trichlorobenzoate.
Chemical Property Profile of (2-Oxo-2-pyrrolidin-1-ylethyl) 2,3,6-trichlorobenzoate
Property Insights of (2-Oxo-2-pyrrolidin-1-ylethyl) 2,3,6-trichlorobenzoate
The XLogP value of 3.426 indicates that (2-Oxo-2-pyrrolidin-1-ylethyl) 2,3,6-trichlorobenzoate is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 46.61 Ų, (2-Oxo-2-pyrrolidin-1-ylethyl) 2,3,6-trichlorobenzoate exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, (2-Oxo-2-pyrrolidin-1-ylethyl) 2,3,6-trichlorobenzoate 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 (2-Oxo-2-pyrrolidin-1-ylethyl) 2,3,6-trichlorobenzoate?
The CAS number of (2-Oxo-2-pyrrolidin-1-ylethyl) 2,3,6-trichlorobenzoate is 721892-93-9.
What is the molecular formula of (2-Oxo-2-pyrrolidin-1-ylethyl) 2,3,6-trichlorobenzoate?
The molecular formula of (2-Oxo-2-pyrrolidin-1-ylethyl) 2,3,6-trichlorobenzoate is C13H12Cl3NO3.
What is the molecular weight of (2-Oxo-2-pyrrolidin-1-ylethyl) 2,3,6-trichlorobenzoate?
The molecular weight of (2-Oxo-2-pyrrolidin-1-ylethyl) 2,3,6-trichlorobenzoate is 334.99 g/mol.
Where can I buy (2-Oxo-2-pyrrolidin-1-ylethyl) 2,3,6-trichlorobenzoate?
You can request a quote for (2-Oxo-2-pyrrolidin-1-ylethyl) 2,3,6-trichlorobenzoate directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for (2-Oxo-2-pyrrolidin-1-ylethyl) 2,3,6-trichlorobenzoate?
Yes, KEHONG BIO provides custom synthesis services for (2-Oxo-2-pyrrolidin-1-ylethyl) 2,3,6-trichlorobenzoate and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.