Benzene, (3-iodo-2,2-dimethylpropyl)-
TL;DR: Benzene, (3-iodo-2,2-dimethylpropyl)- (CAS 40548-64-9) is a chemical compound with molecular formula C11H15I and molecular weight 274.02 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
(3-iodo-2,2-dimethylpropyl)benzene
Also Known As: (3-Iodo-2,2-dimethylpropyl)benzene, 1-Iodo-2,2-dimethyl-3-phenylpropane, Benzene, (3-iodo-2,2-dimethylpropyl)-, 1-Phenyl-2,2-dimethyl-3-iodopropane, (3-Iodo-2,2-dimethylpropyl)benzene #
| Molecular Formula | C11H15I |
|---|---|
| Molecular Weight | 274.02 g/mol |
| LogP | 4.7 |
| Topological Polar Surface Area | 0.0 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 0 |
| Rotatable Bonds | 3 |
| Exact Mass | 274.02185 |
| Heavy Atoms | 12 |
| Complexity | 123.0 |
Chemical Identifiers
| CAS Number | 40548-64-9 |
|---|---|
| SMILES | CC(C)(CC1=CC=CC=C1)CI |
| InChIKey | ZBVBKUSSWXJFJE-UHFFFAOYSA-N |
Product Overview
Benzene, (3-iodo-2,2-dimethylpropyl)- (CAS 40548-64-9), with molecular formula C11H15I and molecular weight 274.02 g/mol. IUPAC: (3-iodo-2,2-dimethylpropyl)benzene.
Chemical Property Profile of Benzene, (3-iodo-2,2-dimethylpropyl)-
Property Insights of Benzene, (3-iodo-2,2-dimethylpropyl)-
The XLogP value of 4.7 indicates that Benzene, (3-iodo-2,2-dimethylpropyl)- 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-2,2-dimethylpropyl)- exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, Benzene, (3-iodo-2,2-dimethylpropyl)- 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 Benzene, (3-iodo-2,2-dimethylpropyl)-?
The CAS number of Benzene, (3-iodo-2,2-dimethylpropyl)- is 40548-64-9.
What is the molecular formula of Benzene, (3-iodo-2,2-dimethylpropyl)-?
The molecular formula of Benzene, (3-iodo-2,2-dimethylpropyl)- is C11H15I.
What is the molecular weight of Benzene, (3-iodo-2,2-dimethylpropyl)-?
The molecular weight of Benzene, (3-iodo-2,2-dimethylpropyl)- is 274.02 g/mol.
Where can I buy Benzene, (3-iodo-2,2-dimethylpropyl)-?
You can request a quote for Benzene, (3-iodo-2,2-dimethylpropyl)- 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-2,2-dimethylpropyl)-?
Yes, KEHONG BIO provides custom synthesis services for Benzene, (3-iodo-2,2-dimethylpropyl)- and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.