Benzeneethanaminium, N,N,N-trimethyl-, bromide (1:1)
TL;DR: Benzeneethanaminium, N,N,N-trimethyl-, bromide (1:1) (CAS 6068-85-5) 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.
trimethyl(2-phenylethyl)azanium bromide
Also Known As: Phenethyltrimethylammonium bromide, Trimethylphenethylammonium bromide, Ammonium, trimethylphenethyl-, bromide, beta-Phenylethyl-trimethylammonium bromide, trimethyl(phenethyl)azanium bromide
| Molecular Formula | C11H18BrN |
|---|---|
| Molecular Weight | 243.06 g/mol |
| LogP | -1.06 |
| Topological Polar Surface Area | 0.0 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 1 |
| Rotatable Bonds | 3 |
| Exact Mass | 243.06226 |
| Heavy Atoms | 13 |
| Complexity | 117.0 |
Chemical Identifiers
| CAS Number | 6068-85-5 |
|---|---|
| SMILES | C[N+](C)(C)CCC1=CC=CC=C1.[Br-] |
| InChIKey | ZOMFHATVODXRID-UHFFFAOYSA-M |
Patent-Derived Application Labels
Derived from 1 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
Benzeneethanaminium, N,N,N-trimethyl-, bromide (1:1) (CAS 6068-85-5), with molecular formula C11H18BrN and molecular weight 243.06 g/mol. IUPAC: trimethyl(2-phenylethyl)azanium bromide.
Chemical Property Profile of Benzeneethanaminium, N,N,N-trimethyl-, bromide (1:1)
Property Insights of Benzeneethanaminium, N,N,N-trimethyl-, bromide (1:1)
The XLogP value of -1.06 indicates that Benzeneethanaminium, N,N,N-trimethyl-, bromide (1:1) 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, Benzeneethanaminium, N,N,N-trimethyl-, bromide (1:1) exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, Benzeneethanaminium, N,N,N-trimethyl-, bromide (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 Benzeneethanaminium, N,N,N-trimethyl-, bromide (1:1)?
The CAS number of Benzeneethanaminium, N,N,N-trimethyl-, bromide (1:1) is 6068-85-5.
What is the molecular formula of Benzeneethanaminium, N,N,N-trimethyl-, bromide (1:1)?
The molecular formula of Benzeneethanaminium, N,N,N-trimethyl-, bromide (1:1) is C11H18BrN.
What is the molecular weight of Benzeneethanaminium, N,N,N-trimethyl-, bromide (1:1)?
The molecular weight of Benzeneethanaminium, N,N,N-trimethyl-, bromide (1:1) is 243.06 g/mol.
Where can I buy Benzeneethanaminium, N,N,N-trimethyl-, bromide (1:1)?
You can request a quote for Benzeneethanaminium, N,N,N-trimethyl-, bromide (1:1) directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Benzeneethanaminium, N,N,N-trimethyl-, bromide (1:1)?
Yes, KEHONG BIO provides custom synthesis services for Benzeneethanaminium, N,N,N-trimethyl-, bromide (1:1) and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.