TL;DR: Acid Red 97 (CAS 10169-02-5) is a chemical compound with molecular formula C32H20N4Na2O8S2 and molecular weight 698.0518 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
disodium;5-[(2-hydroxynaphthalen-1-yl)diazenyl]-2-[4-[(2-hydroxynaphthalen-1-yl)diazenyl]-2-sulfonatophenyl]benzenesulfonate
Also Known As: Acid Red 97, Pharmaglo Red G, Korostan Red G, Azo Milling Red G, Milling Red A
| Molecular Formula | C32H20N4Na2O8S2 |
| Molecular Weight | 698.0518 g/mol |
| XLogP | 1.72 |
| Topological Polar Surface Area (TPSA) | 221.0 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 12 |
| Rotatable Bonds | 5 |
| Exact Mass | 698.0518 Da |
| Heavy Atoms | 48 |
| Complexity | 1190.0 |
| Melting Point | greater than 572 °F (NTP, 1992) |
| Solubility | 1 to 10 mg/mL at 68 °F (NTP, 1992) |
| SMILES | C1=CC=C2C(=C1)C=CC(=C2N=NC3=CC(=C(C=C3)C4=C(C=C(C=C4)N=NC5=C(C=CC6=CC=CC=C65)O)S(=O)(=O)[O-])S(=O)(=O)[O-])O.[Na+].[Na+] |
| InChIKey | JCEBMROGCIEFRX-UHFFFAOYSA-L |
The XLogP value of 1.72 suggests moderate lipophilicity, balancing water solubility and membrane permeability for Acid Red 97. The TPSA of 221.0 Ų indicates high polarity, suggesting Acid Red 97 may have limited membrane permeability but good aqueous solubility. Following Lipinski's Rule of Five, Acid Red 97 has 2 hydrogen bond donor(s) and 12 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
The CAS number of Acid Red 97 is 10169-02-5.
The molecular formula of Acid Red 97 is C32H20N4Na2O8S2.
The molecular weight of Acid Red 97 is 698.0518 g/mol.
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