2,3-Dimethylfumaric acid
TL;DR: 2,3-Dimethylfumaric acid (CAS 22273-90-1) is a chemical compound with molecular formula C6H8O4 and molecular weight 144.04 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
(E)-2,3-dimethylbut-2-enedioic acid
Also Known As: dimethylfumaric acid, 2,3-Dimethylfumaric acid, Dimethylmaleic acid, Fumaric acid, dimethyl-, g-Methylmesaconic acid
| Molecular Formula | C6H8O4 |
|---|---|
| Molecular Weight | 144.04 g/mol |
| LogP | 0.492 |
| Topological Polar Surface Area | 74.6 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 2 |
| Rotatable Bonds | 2 |
| Exact Mass | 144.04225 |
| Heavy Atoms | 10 |
| Complexity | 179.79335 |
Chemical Identifiers
| CAS Number | 22273-90-1 |
|---|---|
| SMILES | C/C(=C(/C)\C(=O)O)/C(=O)O |
Product Overview
2,3-Dimethylfumaric acid (CAS 22273-90-1), with molecular formula C6H8O4 and molecular weight 144.04 g/mol. IUPAC: (E)-2,3-dimethylbut-2-enedioic acid.
Chemical Property Profile of 2,3-Dimethylfumaric acid
Property Insights of 2,3-Dimethylfumaric acid
The XLogP value of 0.492 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 2,3-Dimethylfumaric acid. The TPSA of 74.6 Ų falls within the moderate polarity range, balancing permeability and solubility for 2,3-Dimethylfumaric acid. Following Lipinski's Rule of Five, 2,3-Dimethylfumaric acid has 2 hydrogen bond donor(s) and 2 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 2,3-Dimethylfumaric acid?
The CAS number of 2,3-Dimethylfumaric acid is 22273-90-1.
What is the molecular formula of 2,3-Dimethylfumaric acid?
The molecular formula of 2,3-Dimethylfumaric acid is C6H8O4.
What is the molecular weight of 2,3-Dimethylfumaric acid?
The molecular weight of 2,3-Dimethylfumaric acid is 144.04 g/mol.
Where can I buy 2,3-Dimethylfumaric acid?
You can request a quote for 2,3-Dimethylfumaric acid directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 2,3-Dimethylfumaric acid?
Yes, KEHONG BIO provides custom synthesis services for 2,3-Dimethylfumaric acid and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.