2-Propynoxyethanol
TL;DR: 2-Propynoxyethanol (CAS 3973-18-0) is a chemical compound with molecular formula C5H8O2 and molecular weight 100.05 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2-prop-2-ynoxyethanol
Also Known As: Propynol ethoxylate, 2-Propynoxyethanol, Propargyl-PEG2-alcohol, Ethanol, 2-(2-propynyloxy)-, 2-prop-2-ynoxyethanol
| Molecular Formula | C5H8O2 |
|---|---|
| Molecular Weight | 100.05 g/mol |
| LogP | -0.5 |
| Topological Polar Surface Area | 29.5 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 2 |
| Rotatable Bonds | 3 |
| Exact Mass | 100.05243 |
| Heavy Atoms | 7 |
| Complexity | 69.0 |
Chemical Identifiers
| CAS Number | 3973-18-0 |
|---|---|
| SMILES | C#CCOCCO |
| InChIKey | GHGCQQRMJCSIBQ-UHFFFAOYSA-N |
Patent-Derived Application Labels
Derived from 13 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
2-Propynoxyethanol (CAS 3973-18-0), with molecular formula C5H8O2 and molecular weight 100.05 g/mol. IUPAC: 2-prop-2-ynoxyethanol.
Chemical Property Profile of 2-Propynoxyethanol
Property Insights of 2-Propynoxyethanol
The XLogP value of -0.5 indicates that 2-Propynoxyethanol is hydrophilic (water-soluble), making it suitable for aqueous formulations and biological assay applications. With a topological polar surface area (TPSA) of 29.5 Ų, 2-Propynoxyethanol exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 2-Propynoxyethanol 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-Propynoxyethanol?
The CAS number of 2-Propynoxyethanol is 3973-18-0.
What is the molecular formula of 2-Propynoxyethanol?
The molecular formula of 2-Propynoxyethanol is C5H8O2.
What is the molecular weight of 2-Propynoxyethanol?
The molecular weight of 2-Propynoxyethanol is 100.05 g/mol.
Where can I buy 2-Propynoxyethanol?
You can request a quote for 2-Propynoxyethanol directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 2-Propynoxyethanol?
Yes, KEHONG BIO provides custom synthesis services for 2-Propynoxyethanol and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.