RefChem:564167
TL;DR: RefChem:564167 (CAS 68992-04-1) is a chemical compound with molecular formula C27H23N6Na2O12PS2 and molecular weight 764.03485 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
disodium;2-[[5-carbamoyl-6-hydroxy-4-methyl-2-oxo-1-[2-(4-sulfophenyl)ethyl]-3-pyridinyl]diazenyl]-5-[[3-[hydroxy(oxido)phosphoryl]phenyl]diazenyl]benzenesulfonate
Also Known As: Benzenesulfonic acid, 2-((5-(aminocarbonyl)-1,6-dihydro-2-hydroxy-4-methyl-6-oxo-1-(2-(4-sulfophenyl)ethyl)-3-pyridinyl)azo)-5-((3-phosphonophenyl)azo)-, disodium salt, Benzenesulfonic acid, 2-(2-(5-(aminocarbonyl)-1,6-dihydro-2-hydroxy-4-methyl-6-oxo-1-(2-(4-sulfophenyl)ethyl)-3-pyridinyl)diazenyl)-5-(2-(3-phosphonophenyl)diazenyl)-, sodium salt (1:2), Benzenesulfonic acid, 2-[[5-(aminocarbonyl)-1,6-dihydro-2-hydroxy-4-methyl-6-oxo-1-[2-(4-sulfophenyl)ethyl]-3-pyridinyl]azo]-5-[(3-phosphonophenyl)azo]-, disodium salt, Benzenesulfonic acid, 2-[2-[5-(aminocarbonyl)-1,6-dihydro-2-hydroxy-4-methyl-6-oxo-1-[2-(4-sulfophenyl)ethyl]-3-pyridinyl]diazenyl]-5-[2-(3-phosphonophenyl)diazenyl]-, sodium salt (1:2), Disodium 2-((5-carbamoyl-1,6-dihydro-2-hydroxy-4-methyl-6-oxo-1-(2-(4-sulphonatophenyl)ethyl)-3-pyridyl)azo)-5-((3-phosphonophenyl)azo)benzenesulphonate
Technical Specifications
| Molecular Formula | C27H23N6Na2O12PS2 |
| Molecular Weight | 764.03485 g/mol |
| XLogP | -3.63548 |
| Topological Polar Surface Area (TPSA) | 322.0 Ų |
| Hydrogen Bond Donors | 4 |
| Hydrogen Bond Acceptors | 16 |
| Rotatable Bonds | 10 |
| Exact Mass | 764.03485 Da |
| Heavy Atoms | 50 |
| Complexity | 1620.0 |
| SMILES | CC1=C(C(=O)N(C(=C1C(=O)N)O)CCC2=CC=C(C=C2)S(=O)(=O)O)N=NC3=C(C=C(C=C3)N=NC4=CC(=CC=C4)P(=O)(O)[O-])S(=O)(=O)[O-].[Na+].[Na+] |
| InChIKey | OWAHHDOQEYOCBT-UHFFFAOYSA-L |
Product Description
Applications: RefChem:564167 is used in organic synthesis and process chemistry. It commonly serves as a versatile building block for organic synthesis. Available from CoreyChem as both catalog item and custom-synthesis project (mg to ton scale), with full analytical documentation (COA, MSDS, HPLC, NMR, MS).
A fine chemical supplied by CoreyChem, RefChem:564167 (CAS 68992-04-1) has the molecular formula C27H23N6Na2O12PS2 and a molecular weight of 764.03 g/mol. Synonyms include Benzenesulfonic acid, 2-((5-(aminocarbonyl)-1,6-dihydro-2-hydroxy-4-methyl-6-oxo-1-(2-(4-sulfophenyl)ethyl)-3-pyridinyl)azo)-5-((3-phosphonophenyl)azo)-, disodium salt and Benzenesulfonic acid, 2-(2-(5-(aminocarbonyl)-1,6-dihydro-2-hydroxy-4-methyl-6-oxo-1-(2-(4-sulfophenyl)ethyl)-3-pyridinyl)diazenyl)-5-(2-(3-phosphonophenyl)diazenyl)-, sodium salt (1:2).
Custom synthesis and full analytical documentation (COA/MSDS) are available from CoreyChem. Request a quotation with your required quantity and purity for current lead time and pricing.
Chemical Property Profile of RefChem:564167
Property Insights of RefChem:564167
The XLogP value of -3.63548 indicates that RefChem:564167 is hydrophilic (water-soluble), making it suitable for aqueous formulations and biological assay applications. The TPSA of 322.0 Ų indicates high polarity, suggesting RefChem:564167 may have limited membrane permeability but good aqueous solubility. Following Lipinski's Rule of Five, RefChem:564167 has 4 hydrogen bond donor(s) and 16 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
Frequently Asked Questions
What is the CAS number of RefChem:564167?
The CAS number of RefChem:564167 is 68992-04-1.
What is the molecular formula of RefChem:564167?
The molecular formula of RefChem:564167 is C27H23N6Na2O12PS2.
What is the molecular weight of RefChem:564167?
The molecular weight of RefChem:564167 is 764.03485 g/mol.
What are the applications of RefChem:564167?
RefChem:564167 is used in organic synthesis and process chemistry. It commonly serves as a versatile building block for organic synthesis. Available from CoreyChem as both catalog item and custom-synthesis project (mg to ton scale), with full analytical documentation (COA, MSDS, HPLC, NMR, MS).
Where can I buy RefChem:564167?
You can request a quote for RefChem:564167 directly from CoreyChem. Contact us or email [email protected] for pricing and availability.
Does CoreyChem offer custom synthesis for RefChem:564167?
Yes, CoreyChem provides custom synthesis services for RefChem:564167 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.