Benzenemethanaminium, 4-ethenyl-N,N-dimethyl-N-octyl-, chloride
TL;DR: Benzenemethanaminium, 4-ethenyl-N,N-dimethyl-N-octyl-, chloride (CAS 98473-87-1) is a chemical compound with molecular formula C19H32ClN and molecular weight 309.22 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
(4-ethenylphenyl)methyl-dimethyl-octylazanium chloride
Also Known As: Benzenemethanaminium, 4-ethenyl-N,N-dimethyl-N-octyl-, chloride, (4-ethenylphenyl)methyl-dimethyl-octylazanium,chloride, (4-ethenylphenyl)methyl-dimethyl-octyl-azanium Chloride, Benzenemethanaminium,4-ethenyl-N,N-dimethyl-N-octyl-,chloride, N-[(4-Ethenylphenyl)methyl]-N,N-dimethyloctan-1-aminium chloride
| Molecular Formula | C19H32ClN |
|---|---|
| Molecular Weight | 309.22 g/mol |
| LogP | 2.2705 |
| Topological Polar Surface Area | 0.0 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 0 |
| Rotatable Bonds | 10 |
| Exact Mass | 309.22232 |
| Heavy Atoms | 21 |
| Complexity | 381.05777 |
Chemical Identifiers
| CAS Number | 98473-87-1 |
|---|---|
| SMILES | CCCCCCCC[N+](C)(C)CC1=CC=C(C=C1)C=C.[Cl-] |
Product Overview
Benzenemethanaminium, 4-ethenyl-N,N-dimethyl-N-octyl-, chloride (CAS 98473-87-1), with molecular formula C19H32ClN and molecular weight 309.22 g/mol. IUPAC: (4-ethenylphenyl)methyl-dimethyl-octylazanium chloride.
Chemical Property Profile of Benzenemethanaminium, 4-ethenyl-N,N-dimethyl-N-octyl-, chloride
Property Insights of Benzenemethanaminium, 4-ethenyl-N,N-dimethyl-N-octyl-, chloride
The XLogP value of 2.2705 suggests moderate lipophilicity, balancing water solubility and membrane permeability for Benzenemethanaminium, 4-ethenyl-N,N-dimethyl-N-octyl-, chloride. With a topological polar surface area (TPSA) of 0.0 Ų, Benzenemethanaminium, 4-ethenyl-N,N-dimethyl-N-octyl-, chloride exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, Benzenemethanaminium, 4-ethenyl-N,N-dimethyl-N-octyl-, chloride 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 Benzenemethanaminium, 4-ethenyl-N,N-dimethyl-N-octyl-, chloride?
The CAS number of Benzenemethanaminium, 4-ethenyl-N,N-dimethyl-N-octyl-, chloride is 98473-87-1.
What is the molecular formula of Benzenemethanaminium, 4-ethenyl-N,N-dimethyl-N-octyl-, chloride?
The molecular formula of Benzenemethanaminium, 4-ethenyl-N,N-dimethyl-N-octyl-, chloride is C19H32ClN.
What is the molecular weight of Benzenemethanaminium, 4-ethenyl-N,N-dimethyl-N-octyl-, chloride?
The molecular weight of Benzenemethanaminium, 4-ethenyl-N,N-dimethyl-N-octyl-, chloride is 309.22 g/mol.
Where can I buy Benzenemethanaminium, 4-ethenyl-N,N-dimethyl-N-octyl-, chloride?
You can request a quote for Benzenemethanaminium, 4-ethenyl-N,N-dimethyl-N-octyl-, chloride directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Benzenemethanaminium, 4-ethenyl-N,N-dimethyl-N-octyl-, chloride?
Yes, KEHONG BIO provides custom synthesis services for Benzenemethanaminium, 4-ethenyl-N,N-dimethyl-N-octyl-, chloride and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.