叔丁基碘
TL;DR: 叔丁基碘 (CAS 558-17-8) is a chemical compound with molecular formula C4H9I and molecular weight 183.97 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
叔丁基碘
2-iodo-2-methylpropane
Also Known As: tert-Butyl iodide, 2-Iodo-2-methylpropane, t-butyl iodide, Trimethyliodomethane, Fluoromethane-d3
| Molecular Formula | C4H9I |
|---|---|
| Molecular Weight | 183.97 g/mol |
| LogP | 2.7 |
| Topological Polar Surface Area | 0.0 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 0 |
| Rotatable Bonds | 0 |
| Exact Mass | 183.9749 |
| Heavy Atoms | 5 |
| Complexity | 25.0 |
Chemical Identifiers
| CAS Number | 558-17-8 |
|---|---|
| SMILES | CC(C)(C)I |
| InChIKey | ANGGPYSFTXVERY-UHFFFAOYSA-N |
Patent-Derived Application Labels
Derived from 17 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
叔丁基碘 (CAS 558-17-8), with molecular formula C4H9I and molecular weight 183.97 g/mol. IUPAC: 2-iodo-2-methylpropane.
Chemical Property Profile of 叔丁基碘
Property Insights of 叔丁基碘
The XLogP value of 2.7 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 叔丁基碘. With a topological polar surface area (TPSA) of 0.0 Ų, 叔丁基碘 exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 叔丁基碘 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 叔丁基碘?
The CAS number of 叔丁基碘 is 558-17-8.
What is the molecular formula of 叔丁基碘?
The molecular formula of 叔丁基碘 is C4H9I.
What is the molecular weight of 叔丁基碘?
The molecular weight of 叔丁基碘 is 183.97 g/mol.
Where can I buy 叔丁基碘?
You can request a quote for 叔丁基碘 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 叔丁基碘?
Yes, KEHONG BIO provides custom synthesis services for 叔丁基碘 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.