1-(Oxolan-2-yl)pentane-2,4-diol
TL;DR: 1-(Oxolan-2-yl)pentane-2,4-diol (CAS 69576-65-4) is a chemical compound with molecular formula C9H18O3 and molecular weight 174.13 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
1-(oxolan-2-yl)pentane-2,4-diol
Also Known As: 1-(oxolan-2-yl)pentane-2,4-diol, 1-(tetrahydrofuran-2-yl)pentane-2,4-diol, KST-1B7701, 2,4-Pentanediol,1-(tetrahydro-2-furanyl)-
| Molecular Formula | C9H18O3 |
|---|---|
| Molecular Weight | 174.13 g/mol |
| LogP | 0.5 |
| Topological Polar Surface Area | 49.7 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 4 |
| Exact Mass | 174.1256 |
| Heavy Atoms | 12 |
| Complexity | 127.0 |
Chemical Identifiers
| CAS Number | 69576-65-4 |
|---|---|
| SMILES | CC(CC(CC1CCCO1)O)O |
| InChIKey | UMLZIRVYKWDEPM-UHFFFAOYSA-N |
Product Overview
1-(Oxolan-2-yl)pentane-2,4-diol (CAS 69576-65-4), with molecular formula C9H18O3 and molecular weight 174.13 g/mol. IUPAC: 1-(oxolan-2-yl)pentane-2,4-diol.
Chemical Property Profile of 1-(Oxolan-2-yl)pentane-2,4-diol
Property Insights of 1-(Oxolan-2-yl)pentane-2,4-diol
The XLogP value of 0.5 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 1-(Oxolan-2-yl)pentane-2,4-diol. With a topological polar surface area (TPSA) of 49.7 Ų, 1-(Oxolan-2-yl)pentane-2,4-diol exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 1-(Oxolan-2-yl)pentane-2,4-diol has 2 hydrogen bond donor(s) and 3 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 1-(Oxolan-2-yl)pentane-2,4-diol?
The CAS number of 1-(Oxolan-2-yl)pentane-2,4-diol is 69576-65-4.
What is the molecular formula of 1-(Oxolan-2-yl)pentane-2,4-diol?
The molecular formula of 1-(Oxolan-2-yl)pentane-2,4-diol is C9H18O3.
What is the molecular weight of 1-(Oxolan-2-yl)pentane-2,4-diol?
The molecular weight of 1-(Oxolan-2-yl)pentane-2,4-diol is 174.13 g/mol.
Where can I buy 1-(Oxolan-2-yl)pentane-2,4-diol?
You can request a quote for 1-(Oxolan-2-yl)pentane-2,4-diol directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 1-(Oxolan-2-yl)pentane-2,4-diol?
Yes, KEHONG BIO provides custom synthesis services for 1-(Oxolan-2-yl)pentane-2,4-diol and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.