TL;DR: Acid Violet 12 free acid (CAS 761337-02-4) is a chemical compound with molecular formula C19H17N3O9S2 and molecular weight 495.04062 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
5-acetamido-4-hydroxy-3-[(2-methoxyphenyl)diazenyl]naphthalene-2,7-disulfonic acid
Also Known As: Acid Violet 12 free acid, Acid Brilliant Red 2B, C.i. acid Violet 12, parent, 2,7-Naphthalenedisulfonic acid, 5-(acetylamino)-4-hydroxy-3-((2-methoxyphenyl)azo)-, 2,7-Naphthalenedisulfonic acid, 5-(acetylamino)-4-hydroxy-3-(2-(2-methoxyphenyl)diazenyl)-
| Molecular Formula | C19H17N3O9S2 |
| Molecular Weight | 495.04062 g/mol |
| XLogP | 1.8 |
| Topological Polar Surface Area (TPSA) | 209.0 Ų |
| Hydrogen Bond Donors | 4 |
| Hydrogen Bond Acceptors | 11 |
| Rotatable Bonds | 6 |
| Exact Mass | 495.04062 Da |
| Heavy Atoms | 33 |
| Complexity | 945.0 |
| SMILES | CC(=O)NC1=C2C(=CC(=C1)S(=O)(=O)O)C=C(C(=C2O)N=NC3=CC=CC=C3OC)S(=O)(=O)O |
| InChIKey | GWWYFEYLWLUZFT-UHFFFAOYSA-N |
The XLogP value of 1.8 suggests moderate lipophilicity, balancing water solubility and membrane permeability for Acid Violet 12 free acid. The TPSA of 209.0 Ų indicates high polarity, suggesting Acid Violet 12 free acid may have limited membrane permeability but good aqueous solubility. Following Lipinski's Rule of Five, Acid Violet 12 free acid has 4 hydrogen bond donor(s) and 11 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
The CAS number of Acid Violet 12 free acid is 761337-02-4.
The molecular formula of Acid Violet 12 free acid is C19H17N3O9S2.
The molecular weight of Acid Violet 12 free acid is 495.04062 g/mol.
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