Ammonium, trimethyl(4-phenylbutyl)-, iodide
TL;DR: Ammonium, trimethyl(4-phenylbutyl)-, iodide (CAS 60924-63-2) is a chemical compound with molecular formula C13H22IN and molecular weight 319.08 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
trimethyl(4-phenylbutyl)azanium iodide
Also Known As: Phenbutyl-trimethylammonium iodide, Trimethyl(4-phenylbutyl)ammonium iodide, delta-Phenylbutyl-trimethylammonium iodide, AMMONIUM, TRIMETHYL(4-PHENYLBUTYL)-, IODIDE, trimethyl(4-phenylbutyl)azanium iodide
| Molecular Formula | C13H22IN |
|---|---|
| Molecular Weight | 319.08 g/mol |
| LogP | -0.28 |
| Topological Polar Surface Area | 0.0 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 1 |
| Rotatable Bonds | 5 |
| Exact Mass | 319.0797 |
| Heavy Atoms | 15 |
| Complexity | 140.0 |
Chemical Identifiers
| CAS Number | 60924-63-2 |
|---|---|
| SMILES | C[N+](C)(C)CCCCC1=CC=CC=C1.[I-] |
| InChIKey | PGTOCUMXBOROHQ-UHFFFAOYSA-M |
Patent-Derived Application Labels
Derived from 2 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
Ammonium, trimethyl(4-phenylbutyl)-, iodide (CAS 60924-63-2), with molecular formula C13H22IN and molecular weight 319.08 g/mol. IUPAC: trimethyl(4-phenylbutyl)azanium iodide.
Chemical Property Profile of Ammonium, trimethyl(4-phenylbutyl)-, iodide
Property Insights of Ammonium, trimethyl(4-phenylbutyl)-, iodide
The XLogP value of -0.28 indicates that Ammonium, trimethyl(4-phenylbutyl)-, iodide 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, Ammonium, trimethyl(4-phenylbutyl)-, iodide exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, Ammonium, trimethyl(4-phenylbutyl)-, iodide 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 Ammonium, trimethyl(4-phenylbutyl)-, iodide?
The CAS number of Ammonium, trimethyl(4-phenylbutyl)-, iodide is 60924-63-2.
What is the molecular formula of Ammonium, trimethyl(4-phenylbutyl)-, iodide?
The molecular formula of Ammonium, trimethyl(4-phenylbutyl)-, iodide is C13H22IN.
What is the molecular weight of Ammonium, trimethyl(4-phenylbutyl)-, iodide?
The molecular weight of Ammonium, trimethyl(4-phenylbutyl)-, iodide is 319.08 g/mol.
Where can I buy Ammonium, trimethyl(4-phenylbutyl)-, iodide?
You can request a quote for Ammonium, trimethyl(4-phenylbutyl)-, iodide directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Ammonium, trimethyl(4-phenylbutyl)-, iodide?
Yes, KEHONG BIO provides custom synthesis services for Ammonium, trimethyl(4-phenylbutyl)-, iodide and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.