Pyridinium, 2-methyl-1-(phenylmethyl)-, chloride (1:1)
TL;DR: Pyridinium, 2-methyl-1-(phenylmethyl)-, chloride (1:1) (CAS 13686-87-8) is a chemical compound with molecular formula C13H14ClN and molecular weight 219.08 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
1-benzyl-2-methylpyridin-1-ium chloride
Also Known As: Pyridinium, chloride, Benzyl-2-methylpyridinium chloride, 1-Benzyl-2-picolinium chloride, 2-Picolinium, chloride, Benzyl-alpha-picolinium chloride
| Molecular Formula | C13H14ClN |
|---|---|
| Molecular Weight | 219.08 g/mol |
| LogP | -0.67 |
| Topological Polar Surface Area | 3.9 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 1 |
| Rotatable Bonds | 2 |
| Exact Mass | 219.08148 |
| Heavy Atoms | 15 |
| Complexity | 161.0 |
Chemical Identifiers
| CAS Number | 13686-87-8 |
|---|---|
| SMILES | CC1=CC=CC=[N+]1CC2=CC=CC=C2.[Cl-] |
| InChIKey | ASHVGNGFCXYXBN-UHFFFAOYSA-M |
Patent-Derived Application Labels
Derived from 7 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
Pyridinium, 2-methyl-1-(phenylmethyl)-, chloride (1:1) (CAS 13686-87-8), with molecular formula C13H14ClN and molecular weight 219.08 g/mol. IUPAC: 1-benzyl-2-methylpyridin-1-ium chloride.
Chemical Property Profile of Pyridinium, 2-methyl-1-(phenylmethyl)-, chloride (1:1)
Property Insights of Pyridinium, 2-methyl-1-(phenylmethyl)-, chloride (1:1)
The XLogP value of -0.67 indicates that Pyridinium, 2-methyl-1-(phenylmethyl)-, chloride (1:1) is hydrophilic (water-soluble), making it suitable for aqueous formulations and biological assay applications. With a topological polar surface area (TPSA) of 3.9 Ų, Pyridinium, 2-methyl-1-(phenylmethyl)-, chloride (1:1) exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, Pyridinium, 2-methyl-1-(phenylmethyl)-, chloride (1:1) 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 Pyridinium, 2-methyl-1-(phenylmethyl)-, chloride (1:1)?
The CAS number of Pyridinium, 2-methyl-1-(phenylmethyl)-, chloride (1:1) is 13686-87-8.
What is the molecular formula of Pyridinium, 2-methyl-1-(phenylmethyl)-, chloride (1:1)?
The molecular formula of Pyridinium, 2-methyl-1-(phenylmethyl)-, chloride (1:1) is C13H14ClN.
What is the molecular weight of Pyridinium, 2-methyl-1-(phenylmethyl)-, chloride (1:1)?
The molecular weight of Pyridinium, 2-methyl-1-(phenylmethyl)-, chloride (1:1) is 219.08 g/mol.
Where can I buy Pyridinium, 2-methyl-1-(phenylmethyl)-, chloride (1:1)?
You can request a quote for Pyridinium, 2-methyl-1-(phenylmethyl)-, chloride (1:1) directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Pyridinium, 2-methyl-1-(phenylmethyl)-, chloride (1:1)?
Yes, KEHONG BIO provides custom synthesis services for Pyridinium, 2-methyl-1-(phenylmethyl)-, chloride (1:1) and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.