2,2,4-Trimethyl-3-hydroxyvaleric acid
TL;DR: 2,2,4-Trimethyl-3-hydroxyvaleric acid (CAS 35763-45-2) is a chemical compound with molecular formula C8H16O3 and molecular weight 160.11 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
3-hydroxy-2,2,4-trimethylpentanoic acid
Also Known As: 3-hydroxy-2,2,4-trimethylpentanoic acid, 3-Hydroxy-2,2,4-trimethyl-pentanoic Acid, 2,2,4-Trimethyl-3-hydroxyvaleric acid, 3-Hydroxy-2,2,4-trimethyl-valeric Acid, Pentanoic acid, 3-hydroxy-2,2,4-trimethyl-
| Molecular Formula | C8H16O3 |
|---|---|
| Molecular Weight | 160.11 g/mol |
| LogP | 1.4 |
| Topological Polar Surface Area | 57.5 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 3 |
| Exact Mass | 160.10994 |
| Heavy Atoms | 11 |
| Complexity | 149.0 |
Chemical Identifiers
| CAS Number | 35763-45-2 |
|---|---|
| SMILES | CC(C)C(C(C)(C)C(=O)O)O |
| InChIKey | OJLBQZJKORZRDZ-UHFFFAOYSA-N |
Patent-Derived Application Labels
Derived from 1 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
2,2,4-Trimethyl-3-hydroxyvaleric acid (CAS 35763-45-2), with molecular formula C8H16O3 and molecular weight 160.11 g/mol. IUPAC: 3-hydroxy-2,2,4-trimethylpentanoic acid.
Chemical Property Profile of 2,2,4-Trimethyl-3-hydroxyvaleric acid
Property Insights of 2,2,4-Trimethyl-3-hydroxyvaleric acid
The XLogP value of 1.4 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 2,2,4-Trimethyl-3-hydroxyvaleric acid. With a topological polar surface area (TPSA) of 57.5 Ų, 2,2,4-Trimethyl-3-hydroxyvaleric acid exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 2,2,4-Trimethyl-3-hydroxyvaleric acid 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 2,2,4-Trimethyl-3-hydroxyvaleric acid?
The CAS number of 2,2,4-Trimethyl-3-hydroxyvaleric acid is 35763-45-2.
What is the molecular formula of 2,2,4-Trimethyl-3-hydroxyvaleric acid?
The molecular formula of 2,2,4-Trimethyl-3-hydroxyvaleric acid is C8H16O3.
What is the molecular weight of 2,2,4-Trimethyl-3-hydroxyvaleric acid?
The molecular weight of 2,2,4-Trimethyl-3-hydroxyvaleric acid is 160.11 g/mol.
Where can I buy 2,2,4-Trimethyl-3-hydroxyvaleric acid?
You can request a quote for 2,2,4-Trimethyl-3-hydroxyvaleric acid directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 2,2,4-Trimethyl-3-hydroxyvaleric acid?
Yes, KEHONG BIO provides custom synthesis services for 2,2,4-Trimethyl-3-hydroxyvaleric acid and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.