4-Hydroxypentan-2-one
TL;DR: 4-Hydroxypentan-2-one (CAS 4161-60-8) is a chemical compound with molecular formula C5H10O2 and molecular weight 102.07 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
4-hydroxypentan-2-one
Also Known As: 4-Hydroxypentan-2-one, 4-HYDROXY-2-PENTANONE, 2-Pentanone, 4-hydroxy-, Pentane-2,4-dione, 2-Pentanone,4-hydroxy
| Molecular Formula | C5H10O2 |
|---|---|
| Molecular Weight | 102.07 g/mol |
| LogP | -0.4 |
| Topological Polar Surface Area | 37.3 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 2 |
| Rotatable Bonds | 2 |
| Exact Mass | 102.06808 |
| Heavy Atoms | 7 |
| Complexity | 68.0 |
Chemical Identifiers
| CAS Number | 4161-60-8 |
|---|---|
| SMILES | CC(CC(=O)C)O |
| InChIKey | PCYZZYAEGNVNMH-UHFFFAOYSA-N |
Patent-Derived Application Labels
Derived from 21 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
4-Hydroxypentan-2-one (CAS 4161-60-8), with molecular formula C5H10O2 and molecular weight 102.07 g/mol. IUPAC: 4-hydroxypentan-2-one.
Chemical Property Profile of 4-Hydroxypentan-2-one
Property Insights of 4-Hydroxypentan-2-one
The XLogP value of -0.4 indicates that 4-Hydroxypentan-2-one is hydrophilic (water-soluble), making it suitable for aqueous formulations and biological assay applications. With a topological polar surface area (TPSA) of 37.3 Ų, 4-Hydroxypentan-2-one exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 4-Hydroxypentan-2-one 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 4-Hydroxypentan-2-one?
The CAS number of 4-Hydroxypentan-2-one is 4161-60-8.
What is the molecular formula of 4-Hydroxypentan-2-one?
The molecular formula of 4-Hydroxypentan-2-one is C5H10O2.
What is the molecular weight of 4-Hydroxypentan-2-one?
The molecular weight of 4-Hydroxypentan-2-one is 102.07 g/mol.
Where can I buy 4-Hydroxypentan-2-one?
You can request a quote for 4-Hydroxypentan-2-one directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 4-Hydroxypentan-2-one?
Yes, KEHONG BIO provides custom synthesis services for 4-Hydroxypentan-2-one and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.