Butanedioic acid, 2-hydroxy-2-(hydroxymethyl)-
TL;DR: Butanedioic acid, 2-hydroxy-2-(hydroxymethyl)- (CAS 2957-09-7) is a chemical compound with molecular formula C5H8O6 and molecular weight 164.03 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
(2R)-2-hydroxy-2-(hydroxymethyl)butanedioic acid
Also Known As: itatartaric acid, 2-Hydroxy-2-(hydroxymethyl)butanedioic acid, Butanedioic acid, 2-hydroxy-2-(hydroxymethyl)-, (2R)-2-hydroxy-2-(hydroxymethyl)butanedioic acid
| Molecular Formula | C5H8O6 |
|---|---|
| Molecular Weight | 164.03 g/mol |
| LogP | -1.7309 |
| Topological Polar Surface Area | 115.06 Ų |
| Hydrogen Bond Donors | 4 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 4 |
| Exact Mass | 164.03209 |
| Heavy Atoms | 11 |
| Complexity | 175.81146 |
Chemical Identifiers
| CAS Number | 2957-09-7 |
|---|---|
| SMILES | C(C(=O)O)[C@@](CO)(C(=O)O)O |
Product Overview
Butanedioic acid, 2-hydroxy-2-(hydroxymethyl)- (CAS 2957-09-7), with molecular formula C5H8O6 and molecular weight 164.03 g/mol. IUPAC: (2R)-2-hydroxy-2-(hydroxymethyl)butanedioic acid.
Chemical Property Profile of Butanedioic acid, 2-hydroxy-2-(hydroxymethyl)-
Property Insights of Butanedioic acid, 2-hydroxy-2-(hydroxymethyl)-
The XLogP value of -1.7309 indicates that Butanedioic acid, 2-hydroxy-2-(hydroxymethyl)- is hydrophilic (water-soluble), making it suitable for aqueous formulations and biological assay applications. The TPSA of 115.06 Ų falls within the moderate polarity range, balancing permeability and solubility for Butanedioic acid, 2-hydroxy-2-(hydroxymethyl)-. Following Lipinski's Rule of Five, Butanedioic acid, 2-hydroxy-2-(hydroxymethyl)- has 4 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 Butanedioic acid, 2-hydroxy-2-(hydroxymethyl)-?
The CAS number of Butanedioic acid, 2-hydroxy-2-(hydroxymethyl)- is 2957-09-7.
What is the molecular formula of Butanedioic acid, 2-hydroxy-2-(hydroxymethyl)-?
The molecular formula of Butanedioic acid, 2-hydroxy-2-(hydroxymethyl)- is C5H8O6.
What is the molecular weight of Butanedioic acid, 2-hydroxy-2-(hydroxymethyl)-?
The molecular weight of Butanedioic acid, 2-hydroxy-2-(hydroxymethyl)- is 164.03 g/mol.
Where can I buy Butanedioic acid, 2-hydroxy-2-(hydroxymethyl)-?
You can request a quote for Butanedioic acid, 2-hydroxy-2-(hydroxymethyl)- directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Butanedioic acid, 2-hydroxy-2-(hydroxymethyl)-?
Yes, KEHONG BIO provides custom synthesis services for Butanedioic acid, 2-hydroxy-2-(hydroxymethyl)- and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.