1-(Iodomethyl)-2,4-dimethylbenzene
TL;DR: 1-(Iodomethyl)-2,4-dimethylbenzene (CAS 102998-69-6) is a chemical compound with molecular formula C9H11I and molecular weight 245.99055 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
1-(iodomethyl)-2,4-dimethylbenzene
Also Known As: 1-(iodomethyl)-2,4-dimethylbenzene, 2,4-Dimethylbenzyl iodide, 1-(iodomethyl)-2,4-dimethyl-benzene, Benzene,1-(iodomethyl)-2,4-dimethyl-, 1-iodomethyl-2,4-dimethyl-benzene
Technical Specifications
| Molecular Formula | C9H11I |
| Molecular Weight | 245.99055 g/mol |
| XLogP | 3.7 |
| Topological Polar Surface Area (TPSA) | 0.0 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 0 |
| Rotatable Bonds | 1 |
| Exact Mass | 245.99055 Da |
| Heavy Atoms | 10 |
| Complexity | 101.0 |
| SMILES | CC1=CC(=C(C=C1)CI)C |
| InChIKey | FPIGUZMINFLMCN-UHFFFAOYSA-N |
Chemical Property Profile of 1-(Iodomethyl)-2,4-dimethylbenzene
Property Insights of 1-(Iodomethyl)-2,4-dimethylbenzene
The XLogP value of 3.7 indicates that 1-(Iodomethyl)-2,4-dimethylbenzene is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 0.0 Ų, 1-(Iodomethyl)-2,4-dimethylbenzene exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 1-(Iodomethyl)-2,4-dimethylbenzene has 0 hydrogen bond donor(s) and 0 hydrogen bond acceptor(s), all within the drug-like range, suggesting favorable oral bioavailability potential.
Frequently Asked Questions
What is the CAS number of 1-(Iodomethyl)-2,4-dimethylbenzene?
The CAS number of 1-(Iodomethyl)-2,4-dimethylbenzene is 102998-69-6.
What is the molecular formula of 1-(Iodomethyl)-2,4-dimethylbenzene?
The molecular formula of 1-(Iodomethyl)-2,4-dimethylbenzene is C9H11I.
What is the molecular weight of 1-(Iodomethyl)-2,4-dimethylbenzene?
The molecular weight of 1-(Iodomethyl)-2,4-dimethylbenzene is 245.99055 g/mol.
Where can I buy 1-(Iodomethyl)-2,4-dimethylbenzene?
You can request a quote for 1-(Iodomethyl)-2,4-dimethylbenzene directly from CoreyChem. Contact us or email [email protected] for pricing and availability.
Does CoreyChem offer custom synthesis for 1-(Iodomethyl)-2,4-dimethylbenzene?
Yes, CoreyChem provides custom synthesis services for 1-(Iodomethyl)-2,4-dimethylbenzene and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.