2-butyl-1H-pyrrole
TL;DR: 2-butyl-1H-pyrrole (CAS 1551-10-6) is a chemical compound with molecular formula C8H13N and molecular weight 123.1048 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
2-butyl-1H-pyrrole
Also Known As: 2-butyl-1H-pyrrole, butylpyrrole, 2-butylpyrrole, 2-butyl-pyrrole, 2-butyl-1H-pyrrol
Application Areas
Top 5 of 14 IPC patent classification(s) from the SureChEMBL global patent database.
Technical Specifications
| Molecular Formula | C8H13N |
| Molecular Weight | 123.1048 g/mol |
| XLogP | 3.8 |
| Topological Polar Surface Area (TPSA) | 15.8 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 0 |
| Rotatable Bonds | 3 |
| Exact Mass | 123.1048 Da |
| Heavy Atoms | 9 |
| Complexity | 71.0 |
| SMILES | CCCCC1=CC=CN1 |
| InChIKey | OTZWITHPRWRMMX-UHFFFAOYSA-N |
Chemical Property Profile of 2-butyl-1H-pyrrole
Property Insights of 2-butyl-1H-pyrrole
The XLogP value of 3.8 indicates that 2-butyl-1H-pyrrole is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 15.8 Ų, 2-butyl-1H-pyrrole exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 2-butyl-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-butyl-1H-pyrrole?
The CAS number of 2-butyl-1H-pyrrole is 1551-10-6.
What is the molecular formula of 2-butyl-1H-pyrrole?
The molecular formula of 2-butyl-1H-pyrrole is C8H13N.
What is the molecular weight of 2-butyl-1H-pyrrole?
The molecular weight of 2-butyl-1H-pyrrole is 123.1048 g/mol.
Where can I buy 2-butyl-1H-pyrrole?
You can request a quote for 2-butyl-1H-pyrrole directly from CoreyChem. Contact us or email [email protected] for pricing and availability.
Does CoreyChem offer custom synthesis for 2-butyl-1H-pyrrole?
Yes, CoreyChem provides custom synthesis services for 2-butyl-1H-pyrrole and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.