2-((3-Iodopropin-2-yl)oxy)ethanol
TL;DR: 2-((3-Iodopropin-2-yl)oxy)ethanol (CAS 57006-76-5) is a chemical compound with molecular formula C5H7IO2 and molecular weight 225.95 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2-(3-iodoprop-2-ynoxy)ethanol
Also Known As: 2-((3-Iodopropin-2-yl)oxy)ethanol, 2-(3-iodoprop-2-ynoxy)ethanol, 2-[(3-iodopropin-2-yl)oxy]ethanol, 2-(3-Iodo-2-propynyloxy)ethanol, 2-(3-iodo-2-propynyloxy)-ethanol
| Molecular Formula | C5H7IO2 |
|---|---|
| Molecular Weight | 225.95 g/mol |
| LogP | 0.3 |
| Topological Polar Surface Area | 29.5 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 2 |
| Rotatable Bonds | 3 |
| Exact Mass | 225.94908 |
| Heavy Atoms | 8 |
| Complexity | 99.0 |
Chemical Identifiers
| CAS Number | 57006-76-5 |
|---|---|
| SMILES | C(COCC#CI)O |
| InChIKey | OOTSVQHUKFSBSM-UHFFFAOYSA-N |
Patent-Derived Application Labels
Derived from 2 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
2-((3-Iodopropin-2-yl)oxy)ethanol (CAS 57006-76-5), with molecular formula C5H7IO2 and molecular weight 225.95 g/mol. IUPAC: 2-(3-iodoprop-2-ynoxy)ethanol.
Chemical Property Profile of 2-((3-Iodopropin-2-yl)oxy)ethanol
Property Insights of 2-((3-Iodopropin-2-yl)oxy)ethanol
The XLogP value of 0.3 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 2-((3-Iodopropin-2-yl)oxy)ethanol. With a topological polar surface area (TPSA) of 29.5 Ų, 2-((3-Iodopropin-2-yl)oxy)ethanol exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 2-((3-Iodopropin-2-yl)oxy)ethanol has 1 hydrogen bond donor(s) and 2 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 2-((3-Iodopropin-2-yl)oxy)ethanol?
The CAS number of 2-((3-Iodopropin-2-yl)oxy)ethanol is 57006-76-5.
What is the molecular formula of 2-((3-Iodopropin-2-yl)oxy)ethanol?
The molecular formula of 2-((3-Iodopropin-2-yl)oxy)ethanol is C5H7IO2.
What is the molecular weight of 2-((3-Iodopropin-2-yl)oxy)ethanol?
The molecular weight of 2-((3-Iodopropin-2-yl)oxy)ethanol is 225.95 g/mol.
Where can I buy 2-((3-Iodopropin-2-yl)oxy)ethanol?
You can request a quote for 2-((3-Iodopropin-2-yl)oxy)ethanol directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 2-((3-Iodopropin-2-yl)oxy)ethanol?
Yes, KEHONG BIO provides custom synthesis services for 2-((3-Iodopropin-2-yl)oxy)ethanol and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.