Butanedioic acid, 2-methylene-, sodium salt (1:2)
TL;DR: Butanedioic acid, 2-methylene-, sodium salt (1:2) (CAS 5363-69-9) is a chemical compound with molecular formula C5H4Na2O4 and molecular weight 173.99 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
disodium;2-methylidenebutanedioate
Also Known As: Sodium itaconate, disodium itaconate, Disodium methylenesuccinate, Sodium itaconate;, SODIUMITACONATE
| Molecular Formula | C5H4Na2O4 |
|---|---|
| Molecular Weight | 173.99 g/mol |
| LogP | -8.56 |
| Topological Polar Surface Area | 80.3 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 1 |
| Exact Mass | 173.9905 |
| Heavy Atoms | 11 |
| Complexity | 147.0 |
Chemical Identifiers
| CAS Number | 5363-69-9 |
|---|---|
| SMILES | C=C(CC(=O)[O-])C(=O)[O-].[Na+].[Na+] |
| InChIKey | IZZSMHVWMGGQGU-UHFFFAOYSA-L |
Patent-Derived Application Labels
Derived from 16 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
Butanedioic acid, 2-methylene-, sodium salt (1:2) (CAS 5363-69-9), with molecular formula C5H4Na2O4 and molecular weight 173.99 g/mol. IUPAC: disodium;2-methylidenebutanedioate.
Chemical Property Profile of Butanedioic acid, 2-methylene-, sodium salt (1:2)
Property Insights of Butanedioic acid, 2-methylene-, sodium salt (1:2)
The XLogP value of -8.56 indicates that Butanedioic acid, 2-methylene-, sodium salt (1:2) is hydrophilic (water-soluble), making it suitable for aqueous formulations and biological assay applications. The TPSA of 80.3 Ų falls within the moderate polarity range, balancing permeability and solubility for Butanedioic acid, 2-methylene-, sodium salt (1:2). Following Lipinski's Rule of Five, Butanedioic acid, 2-methylene-, sodium salt (1:2) has 0 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-methylene-, sodium salt (1:2)?
The CAS number of Butanedioic acid, 2-methylene-, sodium salt (1:2) is 5363-69-9.
What is the molecular formula of Butanedioic acid, 2-methylene-, sodium salt (1:2)?
The molecular formula of Butanedioic acid, 2-methylene-, sodium salt (1:2) is C5H4Na2O4.
What is the molecular weight of Butanedioic acid, 2-methylene-, sodium salt (1:2)?
The molecular weight of Butanedioic acid, 2-methylene-, sodium salt (1:2) is 173.99 g/mol.
Where can I buy Butanedioic acid, 2-methylene-, sodium salt (1:2)?
You can request a quote for Butanedioic acid, 2-methylene-, sodium salt (1:2) 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-methylene-, sodium salt (1:2)?
Yes, KEHONG BIO provides custom synthesis services for Butanedioic acid, 2-methylene-, sodium salt (1:2) and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.