2-Methyl-1-pyrroline
TL;DR: 2-Methyl-1-pyrroline (CAS 872-32-2) is a chemical compound with molecular formula C5H9N and molecular weight 83.07 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
5-methyl-3,4-dihydro-2H-pyrrole
Also Known As: 2-Methyl-1-pyrroline, 5-methyl-3,4-dihydro-2H-pyrrole, 3,4-Dihydro-5-methyl-2H-pyrrole, 2-Methyl-1-pyrroline 5ml, 2H-pyrrole, 3,4-dihydro-5-methyl-
| Molecular Formula | C5H9N |
|---|---|
| Molecular Weight | 83.07 g/mol |
| LogP | 0.0 |
| Topological Polar Surface Area | 12.4 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 1 |
| Rotatable Bonds | 0 |
| Exact Mass | 83.0735 |
| Heavy Atoms | 6 |
| Complexity | 74.0 |
Chemical Identifiers
| CAS Number | 872-32-2 |
|---|---|
| SMILES | CC1=NCCC1 |
| InChIKey | CTSZPNIMMLSKDV-UHFFFAOYSA-N |
Patent-Derived Application Labels
Derived from 15 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
2-Methyl-1-pyrroline (CAS 872-32-2), with molecular formula C5H9N and molecular weight 83.07 g/mol. IUPAC: 5-methyl-3,4-dihydro-2H-pyrrole.
Chemical Property Profile of 2-Methyl-1-pyrroline
Property Insights of 2-Methyl-1-pyrroline
The XLogP value of 0.0 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 2-Methyl-1-pyrroline. With a topological polar surface area (TPSA) of 12.4 Ų, 2-Methyl-1-pyrroline exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 2-Methyl-1-pyrroline has 0 hydrogen bond donor(s) and 1 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-Methyl-1-pyrroline?
The CAS number of 2-Methyl-1-pyrroline is 872-32-2.
What is the molecular formula of 2-Methyl-1-pyrroline?
The molecular formula of 2-Methyl-1-pyrroline is C5H9N.
What is the molecular weight of 2-Methyl-1-pyrroline?
The molecular weight of 2-Methyl-1-pyrroline is 83.07 g/mol.
Where can I buy 2-Methyl-1-pyrroline?
You can request a quote for 2-Methyl-1-pyrroline directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 2-Methyl-1-pyrroline?
Yes, KEHONG BIO provides custom synthesis services for 2-Methyl-1-pyrroline and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.