Allyl iodide
TL;DR: Allyl iodide (CAS 556-56-9) is a chemical compound with molecular formula C3H5I and molecular weight 167.9436 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
3-iodoprop-1-ene
Also Known As: ALLYL IODIDE, 3-Iodopropene, 3-iodoprop-1-ene, 3-Iodo-1-propene, 3-Iodopropylene
Application Areas
Top 5 of 22 IPC patent classification(s) from the SureChEMBL global patent database.
Technical Specifications
| Molecular Formula | C3H5I |
| Molecular Weight | 167.9436 g/mol |
| XLogP | 2.1 |
| Topological Polar Surface Area (TPSA) | 0.0 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 0 |
| Rotatable Bonds | 1 |
| Exact Mass | 167.9436 Da |
| Heavy Atoms | 4 |
| Complexity | 17.0 |
| SMILES | C=CCI |
| InChIKey | HFEHLDPGIKPNKL-UHFFFAOYSA-N |
Product Description
Applications: Allyl 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. Available from CoreyChem as both catalog item and custom-synthesis project (mg to ton scale), with full analytical documentation (COA, MSDS, HPLC, NMR, MS).
A heterocyclic building block supplied by CoreyChem, Allyl iodide (CAS 556-56-9) has the molecular formula C3H5I and a molecular weight of 167.94 g/mol. Synonyms include ALLYL IODIDE and 3-Iodopropene.
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 Allyl iodide
Property Insights of Allyl iodide
The XLogP value of 2.1 suggests moderate lipophilicity, balancing water solubility and membrane permeability for Allyl iodide. With a topological polar surface area (TPSA) of 0.0 Ų, Allyl iodide exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, Allyl 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 Allyl iodide?
The CAS number of Allyl iodide is 556-56-9.
What is the molecular formula of Allyl iodide?
The molecular formula of Allyl iodide is C3H5I.
What is the molecular weight of Allyl iodide?
The molecular weight of Allyl iodide is 167.9436 g/mol.
What are the applications of Allyl iodide?
Allyl 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. Available from CoreyChem as both catalog item and...
Where can I buy Allyl iodide?
You can request a quote for Allyl iodide directly from CoreyChem. Contact us or email [email protected] for pricing and availability.
Does CoreyChem offer custom synthesis for Allyl iodide?
Yes, CoreyChem provides custom synthesis services for Allyl iodide and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.