Methanesulfinic acid, nitrilotris-, sodium salt (1:3)
TL;DR: Methanesulfinic acid, nitrilotris-, sodium salt (1:3) (CAS 91194-51-3) is a chemical compound with molecular formula C3H6NNa3O6S3 and molecular weight 316.91 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
trisodium;[bis(sulfinatomethyl)amino]methanesulfinate
Also Known As: trisodium nitrilotrimethanesulfinate, Trisodium nitrilotrimethanesulphinate, trisodiumnitrilotrimethanesulphinate, Methanesulfinic acid, nitrilotris-, trisodium salt, tertiaeres p-Chloranilin-N-phosphinoxyd
| Molecular Formula | C3H6NNa3O6S3 |
|---|---|
| Molecular Weight | 316.91 g/mol |
| LogP | -11.1898 |
| Topological Polar Surface Area | 181.0 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 10 |
| Rotatable Bonds | 3 |
| Exact Mass | 316.90503 |
| Heavy Atoms | 16 |
| Complexity | 177.0 |
Chemical Identifiers
| CAS Number | 91194-51-3 |
|---|---|
| SMILES | C(N(CS(=O)[O-])CS(=O)[O-])S(=O)[O-].[Na+].[Na+].[Na+] |
| InChIKey | OHFNPZKURJNQGA-UHFFFAOYSA-K |
Patent-Derived Application Labels
Derived from 4 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
Methanesulfinic acid, nitrilotris-, sodium salt (1:3) (CAS 91194-51-3), with molecular formula C3H6NNa3O6S3 and molecular weight 316.91 g/mol. IUPAC: trisodium;[bis(sulfinatomethyl)amino]methanesulfinate.
Chemical Property Profile of Methanesulfinic acid, nitrilotris-, sodium salt (1:3)
Property Insights of Methanesulfinic acid, nitrilotris-, sodium salt (1:3)
The XLogP value of -11.1898 indicates that Methanesulfinic acid, nitrilotris-, sodium salt (1:3) is hydrophilic (water-soluble), making it suitable for aqueous formulations and biological assay applications. The TPSA of 181.0 Ų indicates high polarity, suggesting Methanesulfinic acid, nitrilotris-, sodium salt (1:3) may have limited membrane permeability but good aqueous solubility. Following Lipinski's Rule of Five, Methanesulfinic acid, nitrilotris-, sodium salt (1:3) has 0 hydrogen bond donor(s) and 10 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 Methanesulfinic acid, nitrilotris-, sodium salt (1:3)?
The CAS number of Methanesulfinic acid, nitrilotris-, sodium salt (1:3) is 91194-51-3.
What is the molecular formula of Methanesulfinic acid, nitrilotris-, sodium salt (1:3)?
The molecular formula of Methanesulfinic acid, nitrilotris-, sodium salt (1:3) is C3H6NNa3O6S3.
What is the molecular weight of Methanesulfinic acid, nitrilotris-, sodium salt (1:3)?
The molecular weight of Methanesulfinic acid, nitrilotris-, sodium salt (1:3) is 316.91 g/mol.
Where can I buy Methanesulfinic acid, nitrilotris-, sodium salt (1:3)?
You can request a quote for Methanesulfinic acid, nitrilotris-, sodium salt (1:3) directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Methanesulfinic acid, nitrilotris-, sodium salt (1:3)?
Yes, KEHONG BIO provides custom synthesis services for Methanesulfinic acid, nitrilotris-, sodium salt (1:3) and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.