Benzene, [3-iodo-2-(iodomethyl)-2-methylpropyl]-
TL;DR: Benzene, [3-iodo-2-(iodomethyl)-2-methylpropyl]- (CAS 40548-52-5) is a chemical compound with molecular formula C11H14I2 and molecular weight 399.92 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
[3-iodo-2-(iodomethyl)-2-methylpropyl]benzene
Also Known As: 2-Benzyl-2-methyl-1,3-dijodpropan, [3-Iodo-2-(iodomethyl)-2-methylpropyl]benzene, Benzene, [3-iodo-2-(iodomethyl)-2-methylpropyl]-, [3-Iodo-2-(iodomethyl)-2-methylpropyl]benzene #
| Molecular Formula | C11H14I2 |
|---|---|
| Molecular Weight | 399.92 g/mol |
| LogP | 5.4 |
| Topological Polar Surface Area | 0.0 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 0 |
| Rotatable Bonds | 4 |
| Exact Mass | 399.9185 |
| Heavy Atoms | 13 |
| Complexity | 135.0 |
Chemical Identifiers
| CAS Number | 40548-52-5 |
|---|---|
| SMILES | CC(CC1=CC=CC=C1)(CI)CI |
| InChIKey | OZQZLHOWSSVIBC-UHFFFAOYSA-N |
Product Overview
Benzene, [3-iodo-2-(iodomethyl)-2-methylpropyl]- (CAS 40548-52-5), with molecular formula C11H14I2 and molecular weight 399.92 g/mol. IUPAC: [3-iodo-2-(iodomethyl)-2-methylpropyl]benzene.
Chemical Property Profile of Benzene, [3-iodo-2-(iodomethyl)-2-methylpropyl]-
Property Insights of Benzene, [3-iodo-2-(iodomethyl)-2-methylpropyl]-
The XLogP value of 5.4 indicates that Benzene, [3-iodo-2-(iodomethyl)-2-methylpropyl]- is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 0.0 Ų, Benzene, [3-iodo-2-(iodomethyl)-2-methylpropyl]- exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, Benzene, [3-iodo-2-(iodomethyl)-2-methylpropyl]- has 0 hydrogen bond donor(s) and 0 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of Benzene, [3-iodo-2-(iodomethyl)-2-methylpropyl]-?
The CAS number of Benzene, [3-iodo-2-(iodomethyl)-2-methylpropyl]- is 40548-52-5.
What is the molecular formula of Benzene, [3-iodo-2-(iodomethyl)-2-methylpropyl]-?
The molecular formula of Benzene, [3-iodo-2-(iodomethyl)-2-methylpropyl]- is C11H14I2.
What is the molecular weight of Benzene, [3-iodo-2-(iodomethyl)-2-methylpropyl]-?
The molecular weight of Benzene, [3-iodo-2-(iodomethyl)-2-methylpropyl]- is 399.92 g/mol.
Where can I buy Benzene, [3-iodo-2-(iodomethyl)-2-methylpropyl]-?
You can request a quote for Benzene, [3-iodo-2-(iodomethyl)-2-methylpropyl]- directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Benzene, [3-iodo-2-(iodomethyl)-2-methylpropyl]-?
Yes, KEHONG BIO provides custom synthesis services for Benzene, [3-iodo-2-(iodomethyl)-2-methylpropyl]- and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.