Vat green 1,solubilised
TL;DR: Vat green 1,solubilised (CAS 2538-84-3) is a chemical compound with molecular formula C36H20Na2O10S2 and molecular weight 722.03 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
disodium;(30,34-dimethoxy-21-sulfonatooxy-12-nonacyclo[18.10.2.22,5.03,16.04,13.06,11.017,31.022,27.028,32]tetratriaconta-1(30),2(34),3,5(33),6,8,10,12,14,16,18,20,22,24,26,28,31-heptadecaenyl) sulfate
Also Known As: Vat green 1,solubilised, Vat Green 1, Solubilised, C.I. SOLUBILISED VAT GREEN 1, Disodium 16,17-dimethoxyanthra(9,1,2-cde)benzo(rst)pentaphene-5,10-diyl bis(sulphate), disodium 16,17-dimethoxyanthra[9,1,2-cde]benzo[rst]pentaphene-5,10-diyl disulfate
| Molecular Formula | C36H20Na2O10S2 |
|---|---|
| Molecular Weight | 722.03 g/mol |
| LogP | 1.49 |
| Topological Polar Surface Area | 168.0 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 10 |
| Rotatable Bonds | 4 |
| Exact Mass | 722.02936 |
| Heavy Atoms | 50 |
| Complexity | 1310.0 |
Chemical Identifiers
| CAS Number | 2538-84-3 |
|---|---|
| SMILES | COC1=C2C3=C4C(=C(C5=CC=CC=C5C4=C1)OS(=O)(=O)[O-])C=CC3=C6C=CC7=C(C8=CC=CC=C8C9=CC(=C2C6=C79)OC)OS(=O)(=O)[O-].[Na+].[Na+] |
| InChIKey | OFRNYPVEFOPHIL-UHFFFAOYSA-L |
Patent-Derived Application Labels
Derived from 5 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
Vat green 1,solubilised (CAS 2538-84-3), with molecular formula C36H20Na2O10S2 and molecular weight 722.03 g/mol. IUPAC: disodium;(30,34-dimethoxy-21-sulfonatooxy-12-nonacyclo[18.10.2.22,5.03,16.04,13.06,11.017,31.022,27.028,32]tetratriaconta-1(30),2(34),3,5(33),6,8,10,12,14,16,18,20,22,24,26,28,31-heptadecaenyl) sulfate.
Chemical Property Profile of Vat green 1,solubilised
Property Insights of Vat green 1,solubilised
The XLogP value of 1.49 suggests moderate lipophilicity, balancing water solubility and membrane permeability for Vat green 1,solubilised. The TPSA of 168.0 Ų indicates high polarity, suggesting Vat green 1,solubilised may have limited membrane permeability but good aqueous solubility. Following Lipinski's Rule of Five, Vat green 1,solubilised has 0 hydrogen bond donor(s) and 10 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of Vat green 1,solubilised?
The CAS number of Vat green 1,solubilised is 2538-84-3.
What is the molecular formula of Vat green 1,solubilised?
The molecular formula of Vat green 1,solubilised is C36H20Na2O10S2.
What is the molecular weight of Vat green 1,solubilised?
The molecular weight of Vat green 1,solubilised is 722.03 g/mol.
Where can I buy Vat green 1,solubilised?
You can request a quote for Vat green 1,solubilised directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Vat green 1,solubilised?
Yes, KEHONG BIO provides custom synthesis services for Vat green 1,solubilised and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.