1H-Benzotriazolium, 1,2-dimethyl-, iodide
TL;DR: 1H-Benzotriazolium, 1,2-dimethyl-, iodide (CAS 109439-90-9) is a chemical compound with molecular formula C8H10IN3 and molecular weight 274.99194 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
1,2-dimethylbenzotriazol-1-ium iodide
Also Known As: 1,2-Dimethyl-1H-benzotriazolium iodide, 1,2-Dimethylbenzotriazolium jodid, 1,2-dimethylbenzotriazol-1-ium;iodide, 1,2-dimethyl-benzotriazolium,iodide, 1,2-Dimethylbenzotriazolium jodid [German]
Technical Specifications
| Molecular Formula | C8H10IN3 |
| Molecular Weight | 274.99194 g/mol |
| XLogP | -2.6 |
| Topological Polar Surface Area (TPSA) | 21.7 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 2 |
| Rotatable Bonds | 0 |
| Exact Mass | 274.99194 Da |
| Heavy Atoms | 12 |
| Complexity | 148.0 |
| SMILES | CN1N=C2C=CC=CC2=[N+]1C.[I-] |
| InChIKey | BOZFRVNZMQCBDM-UHFFFAOYSA-M |
Chemical Property Profile of 1H-Benzotriazolium, 1,2-dimethyl-, iodide
Property Insights of 1H-Benzotriazolium, 1,2-dimethyl-, iodide
The XLogP value of -2.6 indicates that 1H-Benzotriazolium, 1,2-dimethyl-, iodide is hydrophilic (water-soluble), making it suitable for aqueous formulations and biological assay applications. With a topological polar surface area (TPSA) of 21.7 Ų, 1H-Benzotriazolium, 1,2-dimethyl-, iodide exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 1H-Benzotriazolium, 1,2-dimethyl-, iodide has 0 hydrogen bond donor(s) and 2 hydrogen bond acceptor(s), all within the drug-like range, suggesting favorable oral bioavailability potential.
Frequently Asked Questions
What is the CAS number of 1H-Benzotriazolium, 1,2-dimethyl-, iodide?
The CAS number of 1H-Benzotriazolium, 1,2-dimethyl-, iodide is 109439-90-9.
What is the molecular formula of 1H-Benzotriazolium, 1,2-dimethyl-, iodide?
The molecular formula of 1H-Benzotriazolium, 1,2-dimethyl-, iodide is C8H10IN3.
What is the molecular weight of 1H-Benzotriazolium, 1,2-dimethyl-, iodide?
The molecular weight of 1H-Benzotriazolium, 1,2-dimethyl-, iodide is 274.99194 g/mol.
Where can I buy 1H-Benzotriazolium, 1,2-dimethyl-, iodide?
You can request a quote for 1H-Benzotriazolium, 1,2-dimethyl-, iodide directly from CoreyChem. Contact us or email [email protected] for pricing and availability.
Does CoreyChem offer custom synthesis for 1H-Benzotriazolium, 1,2-dimethyl-, iodide?
Yes, CoreyChem provides custom synthesis services for 1H-Benzotriazolium, 1,2-dimethyl-, iodide and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.