2,3,4-Trimethyl-1H-pyrrole
TL;DR: 2,3,4-Trimethyl-1H-pyrrole (CAS 3855-78-5) is a chemical compound with molecular formula C7H11N and molecular weight 109.09 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2,3,4-trimethyl-1H-pyrrole
Also Known As: 2,3,4-Trimethyl-1H-pyrrole, 2,3,4-Trimethylpyrrole, 2,3,4-trimethyl pyrrole, 2,3,4-trimethyl-1H-pyrrol, pyrrole, 2,3,4-trimethyl-
| Molecular Formula | C7H11N |
|---|---|
| Molecular Weight | 109.09 g/mol |
| LogP | 1.8 |
| Topological Polar Surface Area | 15.8 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 0 |
| Rotatable Bonds | 0 |
| Exact Mass | 109.08915 |
| Heavy Atoms | 8 |
| Complexity | 80.0 |
Chemical Identifiers
| CAS Number | 3855-78-5 |
|---|---|
| SMILES | CC1=CNC(=C1C)C |
| InChIKey | WTMJHBZSSSDBFQ-UHFFFAOYSA-N |
Patent-Derived Application Labels
Derived from 12 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
2,3,4-Trimethyl-1H-pyrrole (CAS 3855-78-5), with molecular formula C7H11N and molecular weight 109.09 g/mol. IUPAC: 2,3,4-trimethyl-1H-pyrrole.
Chemical Property Profile of 2,3,4-Trimethyl-1H-pyrrole
Property Insights of 2,3,4-Trimethyl-1H-pyrrole
The XLogP value of 1.8 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 2,3,4-Trimethyl-1H-pyrrole. With a topological polar surface area (TPSA) of 15.8 Ų, 2,3,4-Trimethyl-1H-pyrrole exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 2,3,4-Trimethyl-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
Frequently Asked Questions
What is the CAS number of 2,3,4-Trimethyl-1H-pyrrole?
The CAS number of 2,3,4-Trimethyl-1H-pyrrole is 3855-78-5.
What is the molecular formula of 2,3,4-Trimethyl-1H-pyrrole?
The molecular formula of 2,3,4-Trimethyl-1H-pyrrole is C7H11N.
What is the molecular weight of 2,3,4-Trimethyl-1H-pyrrole?
The molecular weight of 2,3,4-Trimethyl-1H-pyrrole is 109.09 g/mol.
Where can I buy 2,3,4-Trimethyl-1H-pyrrole?
You can request a quote for 2,3,4-Trimethyl-1H-pyrrole directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 2,3,4-Trimethyl-1H-pyrrole?
Yes, KEHONG BIO provides custom synthesis services for 2,3,4-Trimethyl-1H-pyrrole and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.