Isoquinolinium, 3,4-dihydro-1,2,3,3-tetramethyl-, iodide
TL;DR: Isoquinolinium, 3,4-dihydro-1,2,3,3-tetramethyl-, iodide (CAS 120402-42-8) is a chemical compound with molecular formula C13H18IN and molecular weight 315.0484 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
1,2,3,3-tetramethyl-4H-isoquinolin-2-ium iodide
Also Known As: Isoquinolinium, 3,4-dihydro-1,2,3,3-tetramethyl-, iodide, 1,2,3,3-Tetramethyl-3,4-dihydroisoquinolinium iodide, 3,4-Dihydro-1,2,3,3-tetramethylisoquinolinium iodide, Isoquinolinium, 3,4-dihydro-1,2,3,4-tetramethyl-, iodide, 1,2,3,3-tetramethyl-4H-isoquinolin-2-ium iodide
Technical Specifications
| Molecular Formula | C13H18IN |
| Molecular Weight | 315.0484 g/mol |
| XLogP | -0.5234 |
| Topological Polar Surface Area (TPSA) | 3.0 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 1 |
| Rotatable Bonds | 0 |
| Exact Mass | 315.0484 Da |
| Heavy Atoms | 15 |
| Complexity | 262.0 |
| SMILES | CC1=[N+](C(CC2=CC=CC=C12)(C)C)C.[I-] |
| InChIKey | XNMBGURZTNGYGN-UHFFFAOYSA-M |
Chemical Property Profile of Isoquinolinium, 3,4-dihydro-1,2,3,3-tetramethyl-, iodide
Property Insights of Isoquinolinium, 3,4-dihydro-1,2,3,3-tetramethyl-, iodide
The XLogP value of -0.5234 indicates that Isoquinolinium, 3,4-dihydro-1,2,3,3-tetramethyl-, iodide is hydrophilic (water-soluble), making it suitable for aqueous formulations and biological assay applications. With a topological polar surface area (TPSA) of 3.0 Ų, Isoquinolinium, 3,4-dihydro-1,2,3,3-tetramethyl-, iodide exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, Isoquinolinium, 3,4-dihydro-1,2,3,3-tetramethyl-, 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
What is the CAS number of Isoquinolinium, 3,4-dihydro-1,2,3,3-tetramethyl-, iodide?
The CAS number of Isoquinolinium, 3,4-dihydro-1,2,3,3-tetramethyl-, iodide is 120402-42-8.
What is the molecular formula of Isoquinolinium, 3,4-dihydro-1,2,3,3-tetramethyl-, iodide?
The molecular formula of Isoquinolinium, 3,4-dihydro-1,2,3,3-tetramethyl-, iodide is C13H18IN.
What is the molecular weight of Isoquinolinium, 3,4-dihydro-1,2,3,3-tetramethyl-, iodide?
The molecular weight of Isoquinolinium, 3,4-dihydro-1,2,3,3-tetramethyl-, iodide is 315.0484 g/mol.
Where can I buy Isoquinolinium, 3,4-dihydro-1,2,3,3-tetramethyl-, iodide?
You can request a quote for Isoquinolinium, 3,4-dihydro-1,2,3,3-tetramethyl-, iodide directly from CoreyChem. Contact us or email [email protected] for pricing and availability.
Does CoreyChem offer custom synthesis for Isoquinolinium, 3,4-dihydro-1,2,3,3-tetramethyl-, iodide?
Yes, CoreyChem provides custom synthesis services for Isoquinolinium, 3,4-dihydro-1,2,3,3-tetramethyl-, iodide and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.