2-Hydroxy-2-((hydroxyphosphinyl)methyl)butanedioic acid
TL;DR: 2-Hydroxy-2-((hydroxyphosphinyl)methyl)butanedioic acid (CAS 95114-79-7) is a chemical compound with molecular formula C5H9O7P and molecular weight 212.01 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2-hydroxy-2-(hydroxyphosphonoylmethyl)butanedioic acid
Also Known As: 2-Phosphinomethylmalic acid, 2-Hydroxy-2-((hydroxyphosphinyl)methyl)butanedioic acid, RefChem:909873
| Molecular Formula | C5H9O7P |
|---|---|
| Molecular Weight | 212.01 g/mol |
| LogP | -2.9 |
| Topological Polar Surface Area | 132.0 Ų |
| Hydrogen Bond Donors | 4 |
| Hydrogen Bond Acceptors | 7 |
| Rotatable Bonds | 5 |
| Exact Mass | 212.00859 |
| Heavy Atoms | 13 |
| Complexity | 249.0 |
Chemical Identifiers
| CAS Number | 95114-79-7 |
|---|---|
| SMILES | C(C(=O)O)C(CP(=O)O)(C(=O)O)O |
| InChIKey | ZKRDXWTUWPUWEG-UHFFFAOYSA-N |
Product Overview
2-Hydroxy-2-((hydroxyphosphinyl)methyl)butanedioic acid (CAS 95114-79-7), with molecular formula C5H9O7P and molecular weight 212.01 g/mol. IUPAC: 2-hydroxy-2-(hydroxyphosphonoylmethyl)butanedioic acid.
Chemical Property Profile of 2-Hydroxy-2-((hydroxyphosphinyl)methyl)butanedioic acid
Property Insights of 2-Hydroxy-2-((hydroxyphosphinyl)methyl)butanedioic acid
The XLogP value of -2.9 indicates that 2-Hydroxy-2-((hydroxyphosphinyl)methyl)butanedioic acid is hydrophilic (water-soluble), making it suitable for aqueous formulations and biological assay applications. The TPSA of 132.0 Ų falls within the moderate polarity range, balancing permeability and solubility for 2-Hydroxy-2-((hydroxyphosphinyl)methyl)butanedioic acid. Following Lipinski's Rule of Five, 2-Hydroxy-2-((hydroxyphosphinyl)methyl)butanedioic acid has 4 hydrogen bond donor(s) and 7 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-Hydroxy-2-((hydroxyphosphinyl)methyl)butanedioic acid?
The CAS number of 2-Hydroxy-2-((hydroxyphosphinyl)methyl)butanedioic acid is 95114-79-7.
What is the molecular formula of 2-Hydroxy-2-((hydroxyphosphinyl)methyl)butanedioic acid?
The molecular formula of 2-Hydroxy-2-((hydroxyphosphinyl)methyl)butanedioic acid is C5H9O7P.
What is the molecular weight of 2-Hydroxy-2-((hydroxyphosphinyl)methyl)butanedioic acid?
The molecular weight of 2-Hydroxy-2-((hydroxyphosphinyl)methyl)butanedioic acid is 212.01 g/mol.
Where can I buy 2-Hydroxy-2-((hydroxyphosphinyl)methyl)butanedioic acid?
You can request a quote for 2-Hydroxy-2-((hydroxyphosphinyl)methyl)butanedioic acid directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 2-Hydroxy-2-((hydroxyphosphinyl)methyl)butanedioic acid?
Yes, KEHONG BIO provides custom synthesis services for 2-Hydroxy-2-((hydroxyphosphinyl)methyl)butanedioic acid and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.