2-乙基-2-羟基-3-氧丁酸
TL;DR: 2-乙基-2-羟基-3-氧丁酸 (CAS 3142-65-2) is a chemical compound with molecular formula C6H10O4 and molecular weight 146.06 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2-乙基-2-羟基-3-氧丁酸
2-ethyl-2-hydroxy-3-oxobutanoic acid
Also Known As: Acetohydroxybutyrate, AAAHB, 2-Aceto-2-hydroxybutyrate, 2-Aceto-2-hydroxybutanoate, alpha-aceto-alpha-hydroxybutyrate
| Molecular Formula | C6H10O4 |
|---|---|
| Molecular Weight | 146.06 g/mol |
| LogP | -0.2 |
| Topological Polar Surface Area | 74.6 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 3 |
| Exact Mass | 146.0579 |
| Heavy Atoms | 10 |
| Complexity | 163.0 |
Chemical Identifiers
| CAS Number | 3142-65-2 |
|---|---|
| SMILES | CCC(C(=O)C)(C(=O)O)O |
| InChIKey | VUQLHQFKACOHNZ-UHFFFAOYSA-N |
Patent-Derived Application Labels
Derived from 6 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
2-乙基-2-羟基-3-氧丁酸 (CAS 3142-65-2), with molecular formula C6H10O4 and molecular weight 146.06 g/mol. IUPAC: 2-ethyl-2-hydroxy-3-oxobutanoic acid.
Chemical Property Profile of 2-乙基-2-羟基-3-氧丁酸
Property Insights of 2-乙基-2-羟基-3-氧丁酸
The XLogP value of -0.2 indicates that 2-乙基-2-羟基-3-氧丁酸 is hydrophilic (water-soluble), making it suitable for aqueous formulations and biological assay applications. The TPSA of 74.6 Ų falls within the moderate polarity range, balancing permeability and solubility for 2-乙基-2-羟基-3-氧丁酸. Following Lipinski's Rule of Five, 2-乙基-2-羟基-3-氧丁酸 has 2 hydrogen bond donor(s) and 4 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-乙基-2-羟基-3-氧丁酸?
The CAS number of 2-乙基-2-羟基-3-氧丁酸 is 3142-65-2.
What is the molecular formula of 2-乙基-2-羟基-3-氧丁酸?
The molecular formula of 2-乙基-2-羟基-3-氧丁酸 is C6H10O4.
What is the molecular weight of 2-乙基-2-羟基-3-氧丁酸?
The molecular weight of 2-乙基-2-羟基-3-氧丁酸 is 146.06 g/mol.
Where can I buy 2-乙基-2-羟基-3-氧丁酸?
You can request a quote for 2-乙基-2-羟基-3-氧丁酸 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 2-乙基-2-羟基-3-氧丁酸?
Yes, KEHONG BIO provides custom synthesis services for 2-乙基-2-羟基-3-氧丁酸 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.