Benzenaminium, N,N,N-triethyl-3-hydroxy-, iodide (1:1)
TL;DR: Benzenaminium, N,N,N-triethyl-3-hydroxy-, iodide (1:1) (CAS 68-01-9) is a chemical compound with molecular formula C12H20INO and molecular weight 321.06 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
triethyl-(3-hydroxyphenyl)azanium iodide
Also Known As: N,N,N-Triethyl-3-hydroxyanilinium iodide, Benzenaminium, N,N,N-triethyl-3-hydroxy-, iodide, triethyl-(3-hydroxyphenyl)azanium iodide, Benzenaminium, N,N,N-triethyl-3-hydroxy-, iodide (1:1), Benzenaminium,N,N,N-triethyl-3-hydroxy-, iodide (1:1)
| Molecular Formula | C12H20INO |
|---|---|
| Molecular Weight | 321.06 g/mol |
| LogP | -0.24 |
| Topological Polar Surface Area | 20.2 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 2 |
| Rotatable Bonds | 4 |
| Exact Mass | 321.05896 |
| Heavy Atoms | 15 |
| Complexity | 157.0 |
Chemical Identifiers
| CAS Number | 68-01-9 |
|---|---|
| SMILES | CC[N+](CC)(CC)C1=CC(=CC=C1)O.[I-] |
| InChIKey | FNPDBNVORLQYAG-UHFFFAOYSA-N |
Patent-Derived Application Labels
Derived from 1 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
Benzenaminium, N,N,N-triethyl-3-hydroxy-, iodide (1:1) (CAS 68-01-9), with molecular formula C12H20INO and molecular weight 321.06 g/mol. IUPAC: triethyl-(3-hydroxyphenyl)azanium iodide.
Chemical Property Profile of Benzenaminium, N,N,N-triethyl-3-hydroxy-, iodide (1:1)
Property Insights of Benzenaminium, N,N,N-triethyl-3-hydroxy-, iodide (1:1)
The XLogP value of -0.24 indicates that Benzenaminium, N,N,N-triethyl-3-hydroxy-, iodide (1:1) is hydrophilic (water-soluble), making it suitable for aqueous formulations and biological assay applications. With a topological polar surface area (TPSA) of 20.2 Ų, Benzenaminium, N,N,N-triethyl-3-hydroxy-, iodide (1:1) exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, Benzenaminium, N,N,N-triethyl-3-hydroxy-, iodide (1:1) has 1 hydrogen bond donor(s) and 2 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 Benzenaminium, N,N,N-triethyl-3-hydroxy-, iodide (1:1)?
The CAS number of Benzenaminium, N,N,N-triethyl-3-hydroxy-, iodide (1:1) is 68-01-9.
What is the molecular formula of Benzenaminium, N,N,N-triethyl-3-hydroxy-, iodide (1:1)?
The molecular formula of Benzenaminium, N,N,N-triethyl-3-hydroxy-, iodide (1:1) is C12H20INO.
What is the molecular weight of Benzenaminium, N,N,N-triethyl-3-hydroxy-, iodide (1:1)?
The molecular weight of Benzenaminium, N,N,N-triethyl-3-hydroxy-, iodide (1:1) is 321.06 g/mol.
Where can I buy Benzenaminium, N,N,N-triethyl-3-hydroxy-, iodide (1:1)?
You can request a quote for Benzenaminium, N,N,N-triethyl-3-hydroxy-, iodide (1:1) directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Benzenaminium, N,N,N-triethyl-3-hydroxy-, iodide (1:1)?
Yes, KEHONG BIO provides custom synthesis services for Benzenaminium, N,N,N-triethyl-3-hydroxy-, iodide (1:1) and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.