1H-Pyrrole, 3-methyl-
TL;DR: 1H-Pyrrole, 3-methyl- (CAS 616-43-3) is a chemical compound with molecular formula C5H7N and molecular weight 81.06 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
3-methyl-1H-pyrrole
Also Known As: 3-Methyl-1H-pyrrole, 3-METHYLPYRROLE, 3-Methyl pyrrole, 5-METHYLPYRROLE, 1H-Pyrrole, 3-methyl-
| Molecular Formula | C5H7N |
|---|---|
| Molecular Weight | 81.06 g/mol |
| LogP | 1.1 |
| Topological Polar Surface Area | 15.8 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 0 |
| Rotatable Bonds | 0 |
| Exact Mass | 81.057846 |
| Heavy Atoms | 6 |
| Complexity | 43.0 |
| Melting Point | -48.4 |
| Boiling Point | 143 |
Chemical Identifiers
| CAS Number | 616-43-3 |
|---|---|
| SMILES | CC1=CNC=C1 |
| InChIKey | FEKWWZCCJDUWLY-UHFFFAOYSA-N |
Patent-Derived Application Labels
Derived from 19 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
1H-Pyrrole, 3-methyl- (CAS 616-43-3), with molecular formula C5H7N and molecular weight 81.06 g/mol. IUPAC: 3-methyl-1H-pyrrole.
Chemical Property Profile of 1H-Pyrrole, 3-methyl-
Property Insights of 1H-Pyrrole, 3-methyl-
The XLogP value of 1.1 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 1H-Pyrrole, 3-methyl-. With a topological polar surface area (TPSA) of 15.8 Ų, 1H-Pyrrole, 3-methyl- exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 1H-Pyrrole, 3-methyl- 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
Frequently Asked Questions
What is the CAS number of 1H-Pyrrole, 3-methyl-?
The CAS number of 1H-Pyrrole, 3-methyl- is 616-43-3.
What is the molecular formula of 1H-Pyrrole, 3-methyl-?
The molecular formula of 1H-Pyrrole, 3-methyl- is C5H7N.
What is the molecular weight of 1H-Pyrrole, 3-methyl-?
The molecular weight of 1H-Pyrrole, 3-methyl- is 81.06 g/mol.
Where can I buy 1H-Pyrrole, 3-methyl-?
You can request a quote for 1H-Pyrrole, 3-methyl- directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 1H-Pyrrole, 3-methyl-?
Yes, KEHONG BIO provides custom synthesis services for 1H-Pyrrole, 3-methyl- and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.