2-Hydroxyethyl butyrate
TL;DR: 2-Hydroxyethyl butyrate (CAS 4219-46-9) is a chemical compound with molecular formula C6H12O3 and molecular weight 132.08 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2-hydroxyethyl butanoate
Also Known As: 2-Hydroxyethyl butyrate, 2-hydroxyethyl butanoate, 2-hydroxyethylbutyrate, 2-oxyethyl butyrate, Ethylene glycol 1-butyrate
| Molecular Formula | C6H12O3 |
|---|---|
| Molecular Weight | 132.08 g/mol |
| LogP | 0.3 |
| Topological Polar Surface Area | 46.5 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 5 |
| Exact Mass | 132.07864 |
| Heavy Atoms | 9 |
| Complexity | 80.0 |
Chemical Identifiers
| CAS Number | 4219-46-9 |
|---|---|
| SMILES | CCCC(=O)OCCO |
| InChIKey | GIOCILWWMFZESP-UHFFFAOYSA-N |
Patent-Derived Application Labels
Derived from 22 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
2-Hydroxyethyl butyrate (CAS 4219-46-9), with molecular formula C6H12O3 and molecular weight 132.08 g/mol. IUPAC: 2-hydroxyethyl butanoate.
Chemical Property Profile of 2-Hydroxyethyl butyrate
Property Insights of 2-Hydroxyethyl butyrate
The XLogP value of 0.3 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 2-Hydroxyethyl butyrate. With a topological polar surface area (TPSA) of 46.5 Ų, 2-Hydroxyethyl butyrate exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 2-Hydroxyethyl butyrate has 1 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 2-Hydroxyethyl butyrate?
The CAS number of 2-Hydroxyethyl butyrate is 4219-46-9.
What is the molecular formula of 2-Hydroxyethyl butyrate?
The molecular formula of 2-Hydroxyethyl butyrate is C6H12O3.
What is the molecular weight of 2-Hydroxyethyl butyrate?
The molecular weight of 2-Hydroxyethyl butyrate is 132.08 g/mol.
Where can I buy 2-Hydroxyethyl butyrate?
You can request a quote for 2-Hydroxyethyl butyrate directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 2-Hydroxyethyl butyrate?
Yes, KEHONG BIO provides custom synthesis services for 2-Hydroxyethyl butyrate and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.