Benzyltrimethylammonium chloride
TL;DR: Benzyltrimethylammonium chloride (CAS 56-93-9) is a chemical compound with molecular formula C10H16ClN and molecular weight 185.09712 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
benzyl(trimethyl)azanium chloride
Also Known As: Benzyltrimethylammonium chloride, Tmbac, Hipochem migrator j, N,N,N-Trimethyl-1-phenylmethanaminium chloride, BnMe3NCl;
Application Areas
Top 5 of 22 IPC patent classification(s) from the SureChEMBL global patent database.
Technical Specifications
| Molecular Formula | C10H16ClN |
| Molecular Weight | 185.09712 g/mol |
| XLogP | -1.1 |
| Topological Polar Surface Area (TPSA) | 0.0 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 1 |
| Rotatable Bonds | 2 |
| Exact Mass | 185.09712 Da |
| Heavy Atoms | 12 |
| Complexity | 107.0 |
| Melting Point | 469 °F (NTP, 1992) |
| Boiling Point | greater than 275 °F at 760 mmHg (decomposes) (NTP, 1992) |
| Density | 1.07 at 68 °F (USCG, 1999) - Denser than water; will sink |
| Vapor Pressure | 0.00000022 [mmHg] |
| Solubility | greater than or equal to 100 mg/mL at 65.3 °F (NTP, 1992) |
| SMILES | C[N+](C)(C)CC1=CC=CC=C1.[Cl-] |
| InChIKey | KXHPPCXNWTUNSB-UHFFFAOYSA-M |
Product Description
Applications: Benzyltrimethylammonium chloride is used in polymer chemistry and functional materials synthesis, as well as heterocycle construction in medicinal chemistry and agrochemical discovery. It commonly serves as a versatile building block for organic synthesis. Available from CoreyChem as both catalog item and custom-synthesis project (mg to ton scale), with full analytical documentation (COA, MSDS, HPLC, NMR, MS).
Benzyltrimethylammonium chloride (CAS 56-93-9) is a polymer intermediate with the molecular formula C10H16ClN and a molecular weight of 185.1 g/mol. Key physical properties include a density of 1.07 at 68 °F (USCG, 1999) - Denser than water; will sink g/cm³, a solubility: greater than or equal to 100 mg/mL at 65.3 °F (NTP, 1992). Synonyms include Benzyltrimethylammonium chloride and Tmbac.
Custom synthesis and full analytical documentation (COA/MSDS) are available from CoreyChem. Request a quotation with your required quantity and purity for current lead time and pricing.
Chemical Property Profile of Benzyltrimethylammonium chloride
Property Insights of Benzyltrimethylammonium chloride
The XLogP value of -1.1 indicates that Benzyltrimethylammonium chloride 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, Benzyltrimethylammonium chloride exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, Benzyltrimethylammonium chloride 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
What is the CAS number of Benzyltrimethylammonium chloride?
The CAS number of Benzyltrimethylammonium chloride is 56-93-9.
What is the molecular formula of Benzyltrimethylammonium chloride?
The molecular formula of Benzyltrimethylammonium chloride is C10H16ClN.
What is the molecular weight of Benzyltrimethylammonium chloride?
The molecular weight of Benzyltrimethylammonium chloride is 185.09712 g/mol.
What are the applications of Benzyltrimethylammonium chloride?
Benzyltrimethylammonium chloride is used in polymer chemistry and functional materials synthesis, as well as heterocycle construction in medicinal chemistry and agrochemical discovery. It commonly serves as a versatile building block for organic synthesis. Available from CoreyChem as both...
Where can I buy Benzyltrimethylammonium chloride?
You can request a quote for Benzyltrimethylammonium chloride directly from CoreyChem. Contact us or email [email protected] for pricing and availability.
Does CoreyChem offer custom synthesis for Benzyltrimethylammonium chloride?
Yes, CoreyChem provides custom synthesis services for Benzyltrimethylammonium chloride and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.