1-Iodo-2,4,5-trimethylbenzene
TL;DR: 1-Iodo-2,4,5-trimethylbenzene (CAS 2100-23-4) is a chemical compound with molecular formula C9H11I and molecular weight 245.99 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
1-iodo-2,4,5-trimethylbenzene
Also Known As: 1-iodo-2,4,5-trimethylbenzene, Benzene, 1-iodo-2,4,5-trimethyl-, 1,2,4-Trimethyl-5-iodobenzene, 1-iodo-2,4,5-trimethyl-benzene
| Molecular Formula | C9H11I |
|---|---|
| Molecular Weight | 245.99 g/mol |
| LogP | 3.21646 |
| Topological Polar Surface Area | 0.0 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 0 |
| Rotatable Bonds | 0 |
| Exact Mass | 245.99055 |
| Heavy Atoms | 10 |
| Complexity | 200.90033 |
Chemical Identifiers
| CAS Number | 2100-23-4 |
|---|---|
| SMILES | CC1=CC(=C(C=C1C)I)C |
Product Overview
1-Iodo-2,4,5-trimethylbenzene (CAS 2100-23-4), with molecular formula C9H11I and molecular weight 245.99 g/mol. IUPAC: 1-iodo-2,4,5-trimethylbenzene.
Chemical Property Profile of 1-Iodo-2,4,5-trimethylbenzene
Property Insights of 1-Iodo-2,4,5-trimethylbenzene
The XLogP value of 3.21646 indicates that 1-Iodo-2,4,5-trimethylbenzene 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-Iodo-2,4,5-trimethylbenzene exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 1-Iodo-2,4,5-trimethylbenzene 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
Frequently Asked Questions
What is the CAS number of 1-Iodo-2,4,5-trimethylbenzene?
The CAS number of 1-Iodo-2,4,5-trimethylbenzene is 2100-23-4.
What is the molecular formula of 1-Iodo-2,4,5-trimethylbenzene?
The molecular formula of 1-Iodo-2,4,5-trimethylbenzene is C9H11I.
What is the molecular weight of 1-Iodo-2,4,5-trimethylbenzene?
The molecular weight of 1-Iodo-2,4,5-trimethylbenzene is 245.99 g/mol.
Where can I buy 1-Iodo-2,4,5-trimethylbenzene?
You can request a quote for 1-Iodo-2,4,5-trimethylbenzene directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 1-Iodo-2,4,5-trimethylbenzene?
Yes, KEHONG BIO provides custom synthesis services for 1-Iodo-2,4,5-trimethylbenzene and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.