N,N,N,2-Tetramethyl-3-oxo-2,3-dihydro-1-benzofuran-5-aminium iodide
TL;DR: N,N,N,2-Tetramethyl-3-oxo-2,3-dihydro-1-benzofuran-5-aminium iodide (CAS 31537-98-1) is a chemical compound with molecular formula C12H16INO2 and molecular weight 333.02258 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
trimethyl-(2-methyl-3-oxo-1-benzofuran-5-yl)azanium iodide
Also Known As: 5-Trimethylammonium-2-methylcoumaran-3-one iodine, (2,3-Dihydro-2-methyl-3-oxo-5-benzofuranyl)trimethylammonium iodide, trimethyl-(2-methyl-3-oxo-1-benzofuran-5-yl)azanium iodide, AMMONIUM, (2,3-DIHYDRO-2-METHYL-3-OXO-5-BENZOFURANYL)TRIMETHYL-, IODIDE, N,N,N,2-Tetramethyl-3-oxo-2,3-dihydro-1-benzofuran-5-aminium iodide
Technical Specifications
| Molecular Formula | C12H16INO2 |
| Molecular Weight | 333.02258 g/mol |
| XLogP | -1.15 |
| Topological Polar Surface Area (TPSA) | 26.3 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 1 |
| Exact Mass | 333.02258 Da |
| Heavy Atoms | 16 |
| Complexity | 269.0 |
| SMILES | CC1C(=O)C2=C(O1)C=CC(=C2)[N+](C)(C)C.[I-] |
| InChIKey | DPIFBWVYFLNUDP-UHFFFAOYSA-M |
Chemical Property Profile of N,N,N,2-Tetramethyl-3-oxo-2,3-dihydro-1-benzofuran-5-aminium iodide
Property Insights of N,N,N,2-Tetramethyl-3-oxo-2,3-dihydro-1-benzofuran-5-aminium iodide
The XLogP value of -1.15 indicates that N,N,N,2-Tetramethyl-3-oxo-2,3-dihydro-1-benzofuran-5-aminium iodide is hydrophilic (water-soluble), making it suitable for aqueous formulations and biological assay applications. With a topological polar surface area (TPSA) of 26.3 Ų, N,N,N,2-Tetramethyl-3-oxo-2,3-dihydro-1-benzofuran-5-aminium iodide exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, N,N,N,2-Tetramethyl-3-oxo-2,3-dihydro-1-benzofuran-5-aminium iodide has 0 hydrogen bond donor(s) and 3 hydrogen bond acceptor(s), all within the drug-like range, suggesting favorable oral bioavailability potential.
Frequently Asked Questions
What is the CAS number of N,N,N,2-Tetramethyl-3-oxo-2,3-dihydro-1-benzofuran-5-aminium iodide?
The CAS number of N,N,N,2-Tetramethyl-3-oxo-2,3-dihydro-1-benzofuran-5-aminium iodide is 31537-98-1.
What is the molecular formula of N,N,N,2-Tetramethyl-3-oxo-2,3-dihydro-1-benzofuran-5-aminium iodide?
The molecular formula of N,N,N,2-Tetramethyl-3-oxo-2,3-dihydro-1-benzofuran-5-aminium iodide is C12H16INO2.
What is the molecular weight of N,N,N,2-Tetramethyl-3-oxo-2,3-dihydro-1-benzofuran-5-aminium iodide?
The molecular weight of N,N,N,2-Tetramethyl-3-oxo-2,3-dihydro-1-benzofuran-5-aminium iodide is 333.02258 g/mol.
Where can I buy N,N,N,2-Tetramethyl-3-oxo-2,3-dihydro-1-benzofuran-5-aminium iodide?
You can request a quote for N,N,N,2-Tetramethyl-3-oxo-2,3-dihydro-1-benzofuran-5-aminium iodide directly from CoreyChem. Contact us or email [email protected] for pricing and availability.
Does CoreyChem offer custom synthesis for N,N,N,2-Tetramethyl-3-oxo-2,3-dihydro-1-benzofuran-5-aminium iodide?
Yes, CoreyChem provides custom synthesis services for N,N,N,2-Tetramethyl-3-oxo-2,3-dihydro-1-benzofuran-5-aminium iodide and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.