3,5-Dimethyl-1-(2-phenylethenyl)pyridin-1-ium bromide
TL;DR: 3,5-Dimethyl-1-(2-phenylethenyl)pyridin-1-ium bromide (CAS 7115-00-6) is a chemical compound with molecular formula C15H16BrN and molecular weight 289.05 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
3,5-dimethyl-1-(2-phenylethenyl)pyridin-1-ium bromide
Also Known As: 3,5-Dimethyl-1-styrylpyridinium bromide, Pyridinium, 3,5-dimethyl-1-styryl-, bromide, 3,5-dimethyl-1-(2-phenylethenyl)pyridin-1-ium bromide
| Molecular Formula | C15H16BrN |
|---|---|
| Molecular Weight | 289.05 g/mol |
| LogP | 0.22284 |
| Topological Polar Surface Area | 3.9 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 1 |
| Rotatable Bonds | 2 |
| Exact Mass | 289.0466 |
| Heavy Atoms | 17 |
| Complexity | 218.0 |
Chemical Identifiers
| CAS Number | 7115-00-6 |
|---|---|
| SMILES | CC1=CC(=C[N+](=C1)C=CC2=CC=CC=C2)C.[Br-] |
| InChIKey | IXUMTOCOZFCKOY-UHFFFAOYSA-M |
Product Overview
3,5-Dimethyl-1-(2-phenylethenyl)pyridin-1-ium bromide (CAS 7115-00-6), with molecular formula C15H16BrN and molecular weight 289.05 g/mol. IUPAC: 3,5-dimethyl-1-(2-phenylethenyl)pyridin-1-ium bromide.
Chemical Property Profile of 3,5-Dimethyl-1-(2-phenylethenyl)pyridin-1-ium bromide
Property Insights of 3,5-Dimethyl-1-(2-phenylethenyl)pyridin-1-ium bromide
The XLogP value of 0.22284 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 3,5-Dimethyl-1-(2-phenylethenyl)pyridin-1-ium bromide. With a topological polar surface area (TPSA) of 3.9 Ų, 3,5-Dimethyl-1-(2-phenylethenyl)pyridin-1-ium bromide exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 3,5-Dimethyl-1-(2-phenylethenyl)pyridin-1-ium bromide 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 3,5-Dimethyl-1-(2-phenylethenyl)pyridin-1-ium bromide?
The CAS number of 3,5-Dimethyl-1-(2-phenylethenyl)pyridin-1-ium bromide is 7115-00-6.
What is the molecular formula of 3,5-Dimethyl-1-(2-phenylethenyl)pyridin-1-ium bromide?
The molecular formula of 3,5-Dimethyl-1-(2-phenylethenyl)pyridin-1-ium bromide is C15H16BrN.
What is the molecular weight of 3,5-Dimethyl-1-(2-phenylethenyl)pyridin-1-ium bromide?
The molecular weight of 3,5-Dimethyl-1-(2-phenylethenyl)pyridin-1-ium bromide is 289.05 g/mol.
Where can I buy 3,5-Dimethyl-1-(2-phenylethenyl)pyridin-1-ium bromide?
You can request a quote for 3,5-Dimethyl-1-(2-phenylethenyl)pyridin-1-ium bromide directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 3,5-Dimethyl-1-(2-phenylethenyl)pyridin-1-ium bromide?
Yes, KEHONG BIO provides custom synthesis services for 3,5-Dimethyl-1-(2-phenylethenyl)pyridin-1-ium bromide and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.