2-(3-Chlorophenyl)-1H-pyrrole
TL;DR: 2-(3-Chlorophenyl)-1H-pyrrole (CAS 115464-89-6) is a chemical compound with molecular formula C10H8ClN and molecular weight 177.03453 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
2-(3-chlorophenyl)-1H-pyrrole
Also Known As: 2-(3-chlorophenyl)pyrrole, 2-(3-Chlorophenyl)-1H-pyrrole, 1H-Pyrrole, 2-(3-chlorophenyl)-, J2.100.940G, 1-[5-(4-fluorophenyl)pyrrol-2-yl]methyl-4-(benzo[b]furan-7-yl)piperazine
Application Areas
Top 5 of 2 IPC patent classification(s) from the SureChEMBL global patent database.
Technical Specifications
| Molecular Formula | C10H8ClN |
| Molecular Weight | 177.03453 g/mol |
| XLogP | 2.3 |
| Topological Polar Surface Area (TPSA) | 15.8 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 0 |
| Rotatable Bonds | 1 |
| Exact Mass | 177.03453 Da |
| Heavy Atoms | 12 |
| Complexity | 149.0 |
| SMILES | C1=CC(=CC(=C1)Cl)C2=CC=CN2 |
| InChIKey | HOXQAKYIVLKWTB-UHFFFAOYSA-N |
Chemical Property Profile of 2-(3-Chlorophenyl)-1H-pyrrole
Property Insights of 2-(3-Chlorophenyl)-1H-pyrrole
The XLogP value of 2.3 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 2-(3-Chlorophenyl)-1H-pyrrole. With a topological polar surface area (TPSA) of 15.8 Ų, 2-(3-Chlorophenyl)-1H-pyrrole exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 2-(3-Chlorophenyl)-1H-pyrrole has 1 hydrogen bond donor(s) and 0 hydrogen bond acceptor(s), all within the drug-like range, suggesting favorable oral bioavailability potential.
Frequently Asked Questions
What is the CAS number of 2-(3-Chlorophenyl)-1H-pyrrole?
The CAS number of 2-(3-Chlorophenyl)-1H-pyrrole is 115464-89-6.
What is the molecular formula of 2-(3-Chlorophenyl)-1H-pyrrole?
The molecular formula of 2-(3-Chlorophenyl)-1H-pyrrole is C10H8ClN.
What is the molecular weight of 2-(3-Chlorophenyl)-1H-pyrrole?
The molecular weight of 2-(3-Chlorophenyl)-1H-pyrrole is 177.03453 g/mol.
Where can I buy 2-(3-Chlorophenyl)-1H-pyrrole?
You can request a quote for 2-(3-Chlorophenyl)-1H-pyrrole directly from CoreyChem. Contact us or email [email protected] for pricing and availability.
Does CoreyChem offer custom synthesis for 2-(3-Chlorophenyl)-1H-pyrrole?
Yes, CoreyChem provides custom synthesis services for 2-(3-Chlorophenyl)-1H-pyrrole and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.