![Methyl 2-[2-(2,2,2-trichloroacetyl)pyrrol-1-yl]benzoate structure](/static/products/2592/259243-93-1.webp)
Methyl 2-[2-(2,2,2-trichloroacetyl)pyrrol-1-yl]benzoate
TL;DR: Methyl 2-[2-(2,2,2-trichloroacetyl)pyrrol-1-yl]benzoate (CAS 259243-93-1) is a chemical compound with molecular formula C14H10Cl3NO3 and molecular weight 344.97 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
methyl 2-[2-(2,2,2-trichloroacetyl)pyrrol-1-yl]benzoate
Also Known As: methyl 2-[2-(2,2,2-trichloroacetyl)pyrrol-1-yl]benzoate, Methyl2-[2-(2,2,2-trichloroacetyl)-1h-pyrrol-1-yl]benzoate, methyl 2-[2-(trichloroacetyl)pyrrol-1-yl]benzoate, methyl 2-[2-(2,2,2-trichloroacetyl)-1H-pyrrol-1-yl]benzoate, Methyl 2-[2-(trichloroacetyl)-1H-pyrrol-1-yl]benzoate
| Molecular Formula | C14H10Cl3NO3 |
|---|---|
| Molecular Weight | 344.97 g/mol |
| LogP | 3.8168 |
| Topological Polar Surface Area | 48.3 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 3 |
| Exact Mass | 344.97263 |
| Heavy Atoms | 21 |
| Complexity | 688.7678 |
Chemical Identifiers
| CAS Number | 259243-93-1 |
|---|---|
| SMILES | COC(=O)C1=CC=CC=C1N2C=CC=C2C(=O)C(Cl)(Cl)Cl |
Product Overview
Methyl 2-[2-(2,2,2-trichloroacetyl)pyrrol-1-yl]benzoate (CAS 259243-93-1), with molecular formula C14H10Cl3NO3 and molecular weight 344.97 g/mol. IUPAC: methyl 2-[2-(2,2,2-trichloroacetyl)pyrrol-1-yl]benzoate.
Chemical Property Profile of Methyl 2-[2-(2,2,2-trichloroacetyl)pyrrol-1-yl]benzoate
Property Insights of Methyl 2-[2-(2,2,2-trichloroacetyl)pyrrol-1-yl]benzoate
The XLogP value of 3.8168 indicates that Methyl 2-[2-(2,2,2-trichloroacetyl)pyrrol-1-yl]benzoate is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 48.3 Ų, Methyl 2-[2-(2,2,2-trichloroacetyl)pyrrol-1-yl]benzoate exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, Methyl 2-[2-(2,2,2-trichloroacetyl)pyrrol-1-yl]benzoate 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 Methyl 2-[2-(2,2,2-trichloroacetyl)pyrrol-1-yl]benzoate?
The CAS number of Methyl 2-[2-(2,2,2-trichloroacetyl)pyrrol-1-yl]benzoate is 259243-93-1.
What is the molecular formula of Methyl 2-[2-(2,2,2-trichloroacetyl)pyrrol-1-yl]benzoate?
The molecular formula of Methyl 2-[2-(2,2,2-trichloroacetyl)pyrrol-1-yl]benzoate is C14H10Cl3NO3.
What is the molecular weight of Methyl 2-[2-(2,2,2-trichloroacetyl)pyrrol-1-yl]benzoate?
The molecular weight of Methyl 2-[2-(2,2,2-trichloroacetyl)pyrrol-1-yl]benzoate is 344.97 g/mol.
Where can I buy Methyl 2-[2-(2,2,2-trichloroacetyl)pyrrol-1-yl]benzoate?
You can request a quote for Methyl 2-[2-(2,2,2-trichloroacetyl)pyrrol-1-yl]benzoate 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-(2,2,2-trichloroacetyl)pyrrol-1-yl]benzoate?
Yes, KEHONG BIO provides custom synthesis services for Methyl 2-[2-(2,2,2-trichloroacetyl)pyrrol-1-yl]benzoate and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.