三甲基((3-甲基苯基)甲基)铵溴化物
TL;DR: 三甲基((3-甲基苯基)甲基)铵溴化物 (CAS 21949-11-1) is a chemical compound with molecular formula C11H18BrN and molecular weight 243.06 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
三甲基((3-甲基苯基)甲基)铵溴化物
trimethyl-[(3-methylphenyl)methyl]azanium bromide
Also Known As: 3-methylbenzyl trimethylammonium bromide, Trimethyl-[(3-methylphenyl)methyl]azanium Bromide, n,n,n-trimethyl(3-methylphenyl)methanaminium bromide, Trimethyl-((3-methylphenyl)methyl)azanium bromide, Trimethyl-<3-methyl-benzyl>-ammonium-Bromid
| Molecular Formula | C11H18BrN |
|---|---|
| Molecular Weight | 243.06 g/mol |
| LogP | -0.79 |
| Topological Polar Surface Area | 0.0 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 1 |
| Rotatable Bonds | 2 |
| Exact Mass | 243.06226 |
| Heavy Atoms | 13 |
| Complexity | 134.0 |
Chemical Identifiers
| CAS Number | 21949-11-1 |
|---|---|
| SMILES | CC1=CC(=CC=C1)C[N+](C)(C)C.[Br-] |
| InChIKey | YMZWUHBBOTVKHM-UHFFFAOYSA-M |
Patent-Derived Application Labels
Derived from 1 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
三甲基((3-甲基苯基)甲基)铵溴化物 (CAS 21949-11-1), with molecular formula C11H18BrN and molecular weight 243.06 g/mol. IUPAC: trimethyl-[(3-methylphenyl)methyl]azanium bromide.
Chemical Property Profile of 三甲基((3-甲基苯基)甲基)铵溴化物
Property Insights of 三甲基((3-甲基苯基)甲基)铵溴化物
The XLogP value of -0.79 indicates that 三甲基((3-甲基苯基)甲基)铵溴化物 is hydrophilic (water-soluble), making it suitable for aqueous formulations and biological assay applications. With a topological polar surface area (TPSA) of 0.0 Ų, 三甲基((3-甲基苯基)甲基)铵溴化物 exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 三甲基((3-甲基苯基)甲基)铵溴化物 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 三甲基((3-甲基苯基)甲基)铵溴化物?
The CAS number of 三甲基((3-甲基苯基)甲基)铵溴化物 is 21949-11-1.
What is the molecular formula of 三甲基((3-甲基苯基)甲基)铵溴化物?
The molecular formula of 三甲基((3-甲基苯基)甲基)铵溴化物 is C11H18BrN.
What is the molecular weight of 三甲基((3-甲基苯基)甲基)铵溴化物?
The molecular weight of 三甲基((3-甲基苯基)甲基)铵溴化物 is 243.06 g/mol.
Where can I buy 三甲基((3-甲基苯基)甲基)铵溴化物?
You can request a quote for 三甲基((3-甲基苯基)甲基)铵溴化物 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 三甲基((3-甲基苯基)甲基)铵溴化物?
Yes, KEHONG BIO provides custom synthesis services for 三甲基((3-甲基苯基)甲基)铵溴化物 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.