3-Iodo-2-propynol
TL;DR: 3-Iodo-2-propynol (CAS 1725-82-2) is a chemical compound with molecular formula C3H3IO and molecular weight 181.92 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
3-iodoprop-2-yn-1-ol
Also Known As: 3-Iodo-2-propynol, 3-iodoprop-2-yn-1-ol, 2-Propyn-1-ol, 3-iodo-, 3-iodo-2-propyn-1-ol, 3-iodopropargyl alcohol
| Molecular Formula | C3H3IO |
|---|---|
| Molecular Weight | 181.92 g/mol |
| LogP | 0.5 |
| Topological Polar Surface Area | 20.2 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 1 |
| Rotatable Bonds | 0 |
| Exact Mass | 181.92287 |
| Heavy Atoms | 5 |
| Complexity | 65.0 |
Chemical Identifiers
| CAS Number | 1725-82-2 |
|---|---|
| SMILES | C(C#CI)O |
| InChIKey | JYQJMGROXSSXDR-UHFFFAOYSA-N |
Patent-Derived Application Labels
Derived from 10 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
3-Iodo-2-propynol (CAS 1725-82-2), with molecular formula C3H3IO and molecular weight 181.92 g/mol. IUPAC: 3-iodoprop-2-yn-1-ol.
Chemical Property Profile of 3-Iodo-2-propynol
Property Insights of 3-Iodo-2-propynol
The XLogP value of 0.5 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 3-Iodo-2-propynol. With a topological polar surface area (TPSA) of 20.2 Ų, 3-Iodo-2-propynol exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 3-Iodo-2-propynol has 1 hydrogen bond donor(s) and 1 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 3-Iodo-2-propynol?
The CAS number of 3-Iodo-2-propynol is 1725-82-2.
What is the molecular formula of 3-Iodo-2-propynol?
The molecular formula of 3-Iodo-2-propynol is C3H3IO.
What is the molecular weight of 3-Iodo-2-propynol?
The molecular weight of 3-Iodo-2-propynol is 181.92 g/mol.
Where can I buy 3-Iodo-2-propynol?
You can request a quote for 3-Iodo-2-propynol directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 3-Iodo-2-propynol?
Yes, KEHONG BIO provides custom synthesis services for 3-Iodo-2-propynol and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.