3,4-Dihydro-1-methyl-2H-pyrrolium
TL;DR: 3,4-Dihydro-1-methyl-2H-pyrrolium (CAS 16032-02-3) is a chemical compound with molecular formula C5H10N+ and molecular weight 84.08 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
1-methyl-3,4-dihydro-2H-pyrrol-1-ium
Also Known As: 1-Methylpyrrolinium, N-Methylpyrrolinium, 1-Methyl-delta(1)-pyrrolinium, 1-methyl-3,4-dihydro-2H-pyrrol-1-ium, 1-Methyl-1-pyrroline-1-ium
| Molecular Formula | C5H10N+ |
|---|---|
| Molecular Weight | 84.08 g/mol |
| LogP | -0.4 |
| Topological Polar Surface Area | 3.0 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 0 |
| Rotatable Bonds | 0 |
| Exact Mass | 84.08132 |
| Heavy Atoms | 6 |
| Complexity | 74.0 |
Chemical Identifiers
| CAS Number | 16032-02-3 |
|---|---|
| SMILES | C[N+]1=CCCC1 |
| InChIKey | FDWZAOGDOVQOLD-UHFFFAOYSA-N |
Patent-Derived Application Labels
Derived from 6 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
3,4-Dihydro-1-methyl-2H-pyrrolium (CAS 16032-02-3), with molecular formula C5H10N+ and molecular weight 84.08 g/mol. IUPAC: 1-methyl-3,4-dihydro-2H-pyrrol-1-ium.
Chemical Property Profile of 3,4-Dihydro-1-methyl-2H-pyrrolium
Property Insights of 3,4-Dihydro-1-methyl-2H-pyrrolium
The XLogP value of -0.4 indicates that 3,4-Dihydro-1-methyl-2H-pyrrolium is hydrophilic (water-soluble), making it suitable for aqueous formulations and biological assay applications. With a topological polar surface area (TPSA) of 3.0 Ų, 3,4-Dihydro-1-methyl-2H-pyrrolium exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 3,4-Dihydro-1-methyl-2H-pyrrolium has 0 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 3,4-Dihydro-1-methyl-2H-pyrrolium?
The CAS number of 3,4-Dihydro-1-methyl-2H-pyrrolium is 16032-02-3.
What is the molecular formula of 3,4-Dihydro-1-methyl-2H-pyrrolium?
The molecular formula of 3,4-Dihydro-1-methyl-2H-pyrrolium is C5H10N+.
What is the molecular weight of 3,4-Dihydro-1-methyl-2H-pyrrolium?
The molecular weight of 3,4-Dihydro-1-methyl-2H-pyrrolium is 84.08 g/mol.
Where can I buy 3,4-Dihydro-1-methyl-2H-pyrrolium?
You can request a quote for 3,4-Dihydro-1-methyl-2H-pyrrolium directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 3,4-Dihydro-1-methyl-2H-pyrrolium?
Yes, KEHONG BIO provides custom synthesis services for 3,4-Dihydro-1-methyl-2H-pyrrolium and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.