Butyl iodide
TL;DR: Butyl iodide (CAS 542-69-8) is a chemical compound with molecular formula C4H9I and molecular weight 183.9749 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
1-iodobutane
Also Known As: 1-Iodobutane, Butyl iodide, Butane, 1-iodo-, N-BUTYL IODIDE, 1-iodo-butane
Application Areas
Top 5 of 22 IPC patent classification(s) from the SureChEMBL global patent database.
Technical Specifications
| Molecular Formula | C4H9I |
| Molecular Weight | 183.9749 g/mol |
| XLogP | 3.1 |
| Topological Polar Surface Area (TPSA) | 0.0 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 0 |
| Rotatable Bonds | 2 |
| Exact Mass | 183.9749 Da |
| Heavy Atoms | 5 |
| Complexity | 13.0 |
| Vapor Pressure | 13.9 [mmHg] |
| SMILES | CCCCI |
| InChIKey | KMGBZBJJOKUPIA-UHFFFAOYSA-N |
Product Description
Applications: Butyl iodide is used in heterocycle construction in medicinal chemistry and agrochemical discovery, as well as pharmaceutical synthesis routes and API production. It commonly serves as a versatile building block for organic synthesis. CoreyChem supplies Butyl iodide (CAS 542-69-8) with custom synthesis available from milligram to multi-kilogram scale, supported by COA, MSDS, and HPLC/NMR/MS documentation.
Butyl iodide (CAS 542-69-8) is a heterocyclic building block with the molecular formula C4H9I and a molecular weight of 183.97 g/mol. It is also known as 1-Iodobutane and Butyl iodide.
Custom synthesis and full analytical documentation (COA/MSDS) are available from CoreyChem. Request a quotation with your required quantity and purity for current lead time and pricing.
Chemical Property Profile of Butyl iodide
Property Insights of Butyl iodide
The XLogP value of 3.1 indicates that Butyl iodide is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 0.0 Ų, Butyl iodide exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, Butyl iodide 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 Butyl iodide?
The CAS number of Butyl iodide is 542-69-8.
What is the molecular formula of Butyl iodide?
The molecular formula of Butyl iodide is C4H9I.
What is the molecular weight of Butyl iodide?
The molecular weight of Butyl iodide is 183.9749 g/mol.
What are the applications of Butyl iodide?
Butyl iodide is used in heterocycle construction in medicinal chemistry and agrochemical discovery, as well as pharmaceutical synthesis routes and API production. It commonly serves as a versatile building block for organic synthesis. CoreyChem supplies Butyl iodide (CAS 542-69-8) with custom...
Where can I buy Butyl iodide?
You can request a quote for Butyl iodide directly from CoreyChem. Contact us or email [email protected] for pricing and availability.
Does CoreyChem offer custom synthesis for Butyl iodide?
Yes, CoreyChem provides custom synthesis services for Butyl iodide and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.