Methyl 1-(4-chlorophenyl)pyrrole-2-carboxylate
TL;DR: Methyl 1-(4-chlorophenyl)pyrrole-2-carboxylate (CAS 13179-30-1) is a chemical compound with molecular formula C12H10ClNO2 and molecular weight 235.04001 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
methyl 1-(4-chlorophenyl)pyrrole-2-carboxylate
Also Known As: Maybridge1_007639, methyl 1-(4-chlorophenyl)pyrrole-2-carboxylate, methyl 1-(4-chlorophenyl)-1H-pyrrole-2-carboxylate
Technical Specifications
| Molecular Formula | C12H10ClNO2 |
| Molecular Weight | 235.04001 g/mol |
| XLogP | 3.1 |
| Topological Polar Surface Area (TPSA) | 31.2 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 2 |
| Rotatable Bonds | 3 |
| Exact Mass | 235.04001 Da |
| Heavy Atoms | 16 |
| Complexity | 251.0 |
| SMILES | COC(=O)C1=CC=CN1C2=CC=C(C=C2)Cl |
| InChIKey | BAVIXOYIOHCUKL-UHFFFAOYSA-N |
Chemical Property Profile of Methyl 1-(4-chlorophenyl)pyrrole-2-carboxylate
Property Insights of Methyl 1-(4-chlorophenyl)pyrrole-2-carboxylate
The XLogP value of 3.1 indicates that Methyl 1-(4-chlorophenyl)pyrrole-2-carboxylate is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 31.2 Ų, Methyl 1-(4-chlorophenyl)pyrrole-2-carboxylate exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, Methyl 1-(4-chlorophenyl)pyrrole-2-carboxylate has 0 hydrogen bond donor(s) and 2 hydrogen bond acceptor(s), all within the drug-like range, suggesting favorable oral bioavailability potential.
Frequently Asked Questions
What is the CAS number of Methyl 1-(4-chlorophenyl)pyrrole-2-carboxylate?
The CAS number of Methyl 1-(4-chlorophenyl)pyrrole-2-carboxylate is 13179-30-1.
What is the molecular formula of Methyl 1-(4-chlorophenyl)pyrrole-2-carboxylate?
The molecular formula of Methyl 1-(4-chlorophenyl)pyrrole-2-carboxylate is C12H10ClNO2.
What is the molecular weight of Methyl 1-(4-chlorophenyl)pyrrole-2-carboxylate?
The molecular weight of Methyl 1-(4-chlorophenyl)pyrrole-2-carboxylate is 235.04001 g/mol.
Where can I buy Methyl 1-(4-chlorophenyl)pyrrole-2-carboxylate?
You can request a quote for Methyl 1-(4-chlorophenyl)pyrrole-2-carboxylate directly from CoreyChem. Contact us or email [email protected] for pricing and availability.
Does CoreyChem offer custom synthesis for Methyl 1-(4-chlorophenyl)pyrrole-2-carboxylate?
Yes, CoreyChem provides custom synthesis services for Methyl 1-(4-chlorophenyl)pyrrole-2-carboxylate and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.