1,4-Cyclohexadiene-1-methanaminium, 2-hydoxy-N,N,N-trimethyl-3,6-dioxo-, iodide
TL;DR: 1,4-Cyclohexadiene-1-methanaminium, 2-hydoxy-N,N,N-trimethyl-3,6-dioxo-, iodide (CAS 94483-69-9) is a chemical compound with molecular formula C10H14INO3 and molecular weight 323.00 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
(2-hydroxy-3,6-dioxocyclohexa-1,4-dien-1-yl)methyl-trimethylazanium iodide
Also Known As: 1,4-Cyclohexadiene-1-methanaminium, 2-hydoxy-N,N,N-trimethyl-3,6-dioxo-, iodide, (2-hydroxy-3,6-dioxocyclohexa-1,4-dien-1-yl)methyl-trimethylazanium iodide, (2-hydroxy-3,6-dioxo-1-cyclohexa-1,4-dienyl)methyl-trimethyl-azanium Iodide
| Molecular Formula | C10H14INO3 |
|---|---|
| Molecular Weight | 323.00 g/mol |
| LogP | -2.7833 |
| Topological Polar Surface Area | 54.4 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 2 |
| Exact Mass | 323.00183 |
| Heavy Atoms | 15 |
| Complexity | 345.0 |
Chemical Identifiers
| CAS Number | 94483-69-9 |
|---|---|
| SMILES | C[N+](C)(C)CC1=C(C(=O)C=CC1=O)O.[I-] |
| InChIKey | TVUGVWFAJUWOJG-UHFFFAOYSA-N |
Product Overview
1,4-Cyclohexadiene-1-methanaminium, 2-hydoxy-N,N,N-trimethyl-3,6-dioxo-, iodide (CAS 94483-69-9), with molecular formula C10H14INO3 and molecular weight 323.00 g/mol. IUPAC: (2-hydroxy-3,6-dioxocyclohexa-1,4-dien-1-yl)methyl-trimethylazanium iodide.
Chemical Property Profile of 1,4-Cyclohexadiene-1-methanaminium, 2-hydoxy-N,N,N-trimethyl-3,6-dioxo-, iodide
Property Insights of 1,4-Cyclohexadiene-1-methanaminium, 2-hydoxy-N,N,N-trimethyl-3,6-dioxo-, iodide
The XLogP value of -2.7833 indicates that 1,4-Cyclohexadiene-1-methanaminium, 2-hydoxy-N,N,N-trimethyl-3,6-dioxo-, iodide is hydrophilic (water-soluble), making it suitable for aqueous formulations and biological assay applications. With a topological polar surface area (TPSA) of 54.4 Ų, 1,4-Cyclohexadiene-1-methanaminium, 2-hydoxy-N,N,N-trimethyl-3,6-dioxo-, iodide exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 1,4-Cyclohexadiene-1-methanaminium, 2-hydoxy-N,N,N-trimethyl-3,6-dioxo-, iodide has 1 hydrogen bond donor(s) and 4 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 1,4-Cyclohexadiene-1-methanaminium, 2-hydoxy-N,N,N-trimethyl-3,6-dioxo-, iodide?
The CAS number of 1,4-Cyclohexadiene-1-methanaminium, 2-hydoxy-N,N,N-trimethyl-3,6-dioxo-, iodide is 94483-69-9.
What is the molecular formula of 1,4-Cyclohexadiene-1-methanaminium, 2-hydoxy-N,N,N-trimethyl-3,6-dioxo-, iodide?
The molecular formula of 1,4-Cyclohexadiene-1-methanaminium, 2-hydoxy-N,N,N-trimethyl-3,6-dioxo-, iodide is C10H14INO3.
What is the molecular weight of 1,4-Cyclohexadiene-1-methanaminium, 2-hydoxy-N,N,N-trimethyl-3,6-dioxo-, iodide?
The molecular weight of 1,4-Cyclohexadiene-1-methanaminium, 2-hydoxy-N,N,N-trimethyl-3,6-dioxo-, iodide is 323.00 g/mol.
Where can I buy 1,4-Cyclohexadiene-1-methanaminium, 2-hydoxy-N,N,N-trimethyl-3,6-dioxo-, iodide?
You can request a quote for 1,4-Cyclohexadiene-1-methanaminium, 2-hydoxy-N,N,N-trimethyl-3,6-dioxo-, iodide directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 1,4-Cyclohexadiene-1-methanaminium, 2-hydoxy-N,N,N-trimethyl-3,6-dioxo-, iodide?
Yes, KEHONG BIO provides custom synthesis services for 1,4-Cyclohexadiene-1-methanaminium, 2-hydoxy-N,N,N-trimethyl-3,6-dioxo-, iodide and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.