1,4-Dioxane-2-carboxylic acid
TL;DR: 1,4-Dioxane-2-carboxylic acid (CAS 893641-80-0) is a chemical compound with molecular formula C5H8O4 and molecular weight 132.04 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
1,4-dioxane-2-carboxylic acid
Also Known As: 1,4-dioxane-2-carboxylic Acid, dioxane carboxylic, 1,4-Dioxane-2-carboxylicacid, (R)-1,4-dioxane-2-carboxylic acid, [1,4]dioxane-2-carboxylic acid
| Molecular Formula | C5H8O4 |
|---|---|
| Molecular Weight | 132.04 g/mol |
| LogP | -0.5136 |
| Topological Polar Surface Area | 55.76 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 1 |
| Exact Mass | 132.04225 |
| Heavy Atoms | 9 |
| Complexity | 105.52562 |
Chemical Identifiers
| CAS Number | 893641-80-0 |
|---|---|
| SMILES | C1COC(CO1)C(=O)O |
Product Overview
1,4-Dioxane-2-carboxylic acid (CAS 893641-80-0), with molecular formula C5H8O4 and molecular weight 132.04 g/mol. IUPAC: 1,4-dioxane-2-carboxylic acid.
Chemical Property Profile of 1,4-Dioxane-2-carboxylic acid
Property Insights of 1,4-Dioxane-2-carboxylic acid
The XLogP value of -0.5136 indicates that 1,4-Dioxane-2-carboxylic acid is hydrophilic (water-soluble), making it suitable for aqueous formulations and biological assay applications. With a topological polar surface area (TPSA) of 55.76 Ų, 1,4-Dioxane-2-carboxylic acid exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 1,4-Dioxane-2-carboxylic acid has 1 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 1,4-Dioxane-2-carboxylic acid?
The CAS number of 1,4-Dioxane-2-carboxylic acid is 893641-80-0.
What is the molecular formula of 1,4-Dioxane-2-carboxylic acid?
The molecular formula of 1,4-Dioxane-2-carboxylic acid is C5H8O4.
What is the molecular weight of 1,4-Dioxane-2-carboxylic acid?
The molecular weight of 1,4-Dioxane-2-carboxylic acid is 132.04 g/mol.
Where can I buy 1,4-Dioxane-2-carboxylic acid?
You can request a quote for 1,4-Dioxane-2-carboxylic acid directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 1,4-Dioxane-2-carboxylic acid?
Yes, KEHONG BIO provides custom synthesis services for 1,4-Dioxane-2-carboxylic acid and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.