3,5-二磺酸基苯甲酸钠盐(1:2)
TL;DR: 3,5-二磺酸基苯甲酸钠盐(1:2) (CAS 19089-55-5) is a chemical compound with molecular formula C7H4Na2O8S2 and molecular weight 325.91 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
3,5-二磺酸基苯甲酸钠盐(1:2)
disodium;5-carboxybenzene-1,3-disulfonate
Also Known As: Disodium hydrogen 3,5-disulphonatobenzoate, Benzoic acid, 3,5-disulfo-, disodium salt, disodium 5-carboxybenzene-1,3-disulfonate, Disodium hydrogen3,5-disulphonatobenzoate, 3,5-Disulfobenzoic acid, disodium salt
| Molecular Formula | C7H4Na2O8S2 |
|---|---|
| Molecular Weight | 325.91 g/mol |
| LogP | -6.8 |
| Topological Polar Surface Area | 168.0 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 8 |
| Rotatable Bonds | 1 |
| Exact Mass | 325.9143 |
| Heavy Atoms | 19 |
| Complexity | 426.0 |
Chemical Identifiers
| CAS Number | 19089-55-5 |
|---|---|
| SMILES | C1=C(C=C(C=C1S(=O)(=O)[O-])S(=O)(=O)[O-])C(=O)O.[Na+].[Na+] |
| InChIKey | NCBDBWXOBUXRIC-UHFFFAOYSA-L |
Patent-Derived Application Labels
Derived from 5 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
3,5-二磺酸基苯甲酸钠盐(1:2) (CAS 19089-55-5), with molecular formula C7H4Na2O8S2 and molecular weight 325.91 g/mol. IUPAC: disodium;5-carboxybenzene-1,3-disulfonate.
Chemical Property Profile of 3,5-二磺酸基苯甲酸钠盐(1:2)
Property Insights of 3,5-二磺酸基苯甲酸钠盐(1:2)
The XLogP value of -6.8 indicates that 3,5-二磺酸基苯甲酸钠盐(1:2) is hydrophilic (water-soluble), making it suitable for aqueous formulations and biological assay applications. The TPSA of 168.0 Ų indicates high polarity, suggesting 3,5-二磺酸基苯甲酸钠盐(1:2) may have limited membrane permeability but good aqueous solubility. Following Lipinski's Rule of Five, 3,5-二磺酸基苯甲酸钠盐(1:2) has 1 hydrogen bond donor(s) and 8 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 3,5-二磺酸基苯甲酸钠盐(1:2)?
The CAS number of 3,5-二磺酸基苯甲酸钠盐(1:2) is 19089-55-5.
What is the molecular formula of 3,5-二磺酸基苯甲酸钠盐(1:2)?
The molecular formula of 3,5-二磺酸基苯甲酸钠盐(1:2) is C7H4Na2O8S2.
What is the molecular weight of 3,5-二磺酸基苯甲酸钠盐(1:2)?
The molecular weight of 3,5-二磺酸基苯甲酸钠盐(1:2) is 325.91 g/mol.
Where can I buy 3,5-二磺酸基苯甲酸钠盐(1:2)?
You can request a quote for 3,5-二磺酸基苯甲酸钠盐(1:2) directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 3,5-二磺酸基苯甲酸钠盐(1:2)?
Yes, KEHONG BIO provides custom synthesis services for 3,5-二磺酸基苯甲酸钠盐(1:2) and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.