(2S)-2-hydroxy-2-methylbutanedioate
TL;DR: (2S)-2-hydroxy-2-methylbutanedioate (CAS 2306-22-1) is a chemical compound with molecular formula C5H6O5-2 and molecular weight 146.02 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
(2S)-2-hydroxy-2-methylbutanedioate
Also Known As: L-citramalate, alpha-methylmalate, S-citramalate, (3S)-citramalate, (S)-2-methylmalate
| Molecular Formula | C5H6O5-2 |
|---|---|
| Molecular Weight | 146.02 g/mol |
| LogP | -3.3727 |
| Topological Polar Surface Area | 100.49 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 3 |
| Exact Mass | 146.02153 |
| Heavy Atoms | 10 |
| Complexity | 159.42125 |
Chemical Identifiers
| CAS Number | 2306-22-1 |
|---|---|
| SMILES | C[C@](CC(=O)[O-])(C(=O)[O-])O |
Product Overview
(2S)-2-hydroxy-2-methylbutanedioate (CAS 2306-22-1), with molecular formula C5H6O5-2 and molecular weight 146.02 g/mol. IUPAC: (2S)-2-hydroxy-2-methylbutanedioate.
Chemical Property Profile of (2S)-2-hydroxy-2-methylbutanedioate
Property Insights of (2S)-2-hydroxy-2-methylbutanedioate
The XLogP value of -3.3727 indicates that (2S)-2-hydroxy-2-methylbutanedioate is hydrophilic (water-soluble), making it suitable for aqueous formulations and biological assay applications. The TPSA of 100.49 Ų falls within the moderate polarity range, balancing permeability and solubility for (2S)-2-hydroxy-2-methylbutanedioate. Following Lipinski's Rule of Five, (2S)-2-hydroxy-2-methylbutanedioate has 1 hydrogen bond donor(s) and 5 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 (2S)-2-hydroxy-2-methylbutanedioate?
The CAS number of (2S)-2-hydroxy-2-methylbutanedioate is 2306-22-1.
What is the molecular formula of (2S)-2-hydroxy-2-methylbutanedioate?
The molecular formula of (2S)-2-hydroxy-2-methylbutanedioate is C5H6O5-2.
What is the molecular weight of (2S)-2-hydroxy-2-methylbutanedioate?
The molecular weight of (2S)-2-hydroxy-2-methylbutanedioate is 146.02 g/mol.
Where can I buy (2S)-2-hydroxy-2-methylbutanedioate?
You can request a quote for (2S)-2-hydroxy-2-methylbutanedioate directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for (2S)-2-hydroxy-2-methylbutanedioate?
Yes, KEHONG BIO provides custom synthesis services for (2S)-2-hydroxy-2-methylbutanedioate and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.