2-乙基-3-羟基-3-甲基丁酸
TL;DR: 2-乙基-3-羟基-3-甲基丁酸 (CAS 109106-81-2) is a chemical compound with molecular formula C7H14O3 and molecular weight 146.09 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2-乙基-3-羟基-3-甲基丁酸
2-ethyl-3-hydroxy-3-methylbutanoic acid
Also Known As: 2-ethyl-3-hydroxy-3-methylbutanoic acid, 2-ethyl-3-hydroxy-3-methyl-butanoic acid, ETHYL 3-HYDROXY-3-METHYLBUTYRIC ACID
| Molecular Formula | C7H14O3 |
|---|---|
| Molecular Weight | 146.09 g/mol |
| LogP | 0.6 |
| Topological Polar Surface Area | 57.5 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 3 |
| Exact Mass | 146.0943 |
| Heavy Atoms | 10 |
| Complexity | 129.0 |
Chemical Identifiers
| CAS Number | 109106-81-2 |
|---|---|
| SMILES | CCC(C(=O)O)C(C)(C)O |
| InChIKey | DIRHXPGALYKHLU-UHFFFAOYSA-N |
Patent-Derived Application Labels
Derived from 4 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
2-乙基-3-羟基-3-甲基丁酸 (CAS 109106-81-2), with molecular formula C7H14O3 and molecular weight 146.09 g/mol. IUPAC: 2-ethyl-3-hydroxy-3-methylbutanoic acid.
Chemical Property Profile of 2-乙基-3-羟基-3-甲基丁酸
Property Insights of 2-乙基-3-羟基-3-甲基丁酸
The XLogP value of 0.6 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 2-乙基-3-羟基-3-甲基丁酸. With a topological polar surface area (TPSA) of 57.5 Ų, 2-乙基-3-羟基-3-甲基丁酸 exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 2-乙基-3-羟基-3-甲基丁酸 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 2-乙基-3-羟基-3-甲基丁酸?
The CAS number of 2-乙基-3-羟基-3-甲基丁酸 is 109106-81-2.
What is the molecular formula of 2-乙基-3-羟基-3-甲基丁酸?
The molecular formula of 2-乙基-3-羟基-3-甲基丁酸 is C7H14O3.
What is the molecular weight of 2-乙基-3-羟基-3-甲基丁酸?
The molecular weight of 2-乙基-3-羟基-3-甲基丁酸 is 146.09 g/mol.
Where can I buy 2-乙基-3-羟基-3-甲基丁酸?
You can request a quote for 2-乙基-3-羟基-3-甲基丁酸 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-3-羟基-3-甲基丁酸?
Yes, KEHONG BIO provides custom synthesis services for 2-乙基-3-羟基-3-甲基丁酸 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.