TL;DR: Reactive Blue 19 (CAS 2580-78-1) is a chemical compound with molecular formula C22H16N2Na2O11S3 and molecular weight 625.9712 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
disodium;1-amino-9,10-dioxo-4-[3-(2-sulfonatooxyethylsulfonyl)anilino]anthracene-2-sulfonate
Also Known As: Reactive Blue 19, Remazol brilliant blue R, C.I. Reactive Blue 19, Cavalite Brilliant Blue R, c.i.reactiveblue19
Top 5 of 18 IPC patent classification(s) from the SureChEMBL global patent database.
| Molecular Formula | C22H16N2Na2O11S3 |
| Molecular Weight | 625.9712 g/mol |
| XLogP | -5.05 |
| Topological Polar Surface Area (TPSA) | 255.0 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 13 |
| Rotatable Bonds | 6 |
| Exact Mass | 625.9712 Da |
| Heavy Atoms | 40 |
| Complexity | 1210.0 |
| Melting Point | Decomposes at approximately 581 °F (NTP, 1992) |
| Solubility | 10 to 50 mg/mL at 70 °F (NTP, 1992) |
| SMILES | C1=CC=C2C(=C1)C(=O)C3=C(C2=O)C(=C(C=C3NC4=CC(=CC=C4)S(=O)(=O)CCOS(=O)(=O)[O-])S(=O)(=O)[O-])N.[Na+].[Na+] |
| InChIKey | KUIXZSYWBHSYCN-UHFFFAOYSA-L |
The XLogP value of -5.05 indicates that Reactive Blue 19 is hydrophilic (water-soluble), making it suitable for aqueous formulations and biological assay applications. The TPSA of 255.0 Ų indicates high polarity, suggesting Reactive Blue 19 may have limited membrane permeability but good aqueous solubility. Following Lipinski's Rule of Five, Reactive Blue 19 has 2 hydrogen bond donor(s) and 13 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
The CAS number of Reactive Blue 19 is 2580-78-1.
The molecular formula of Reactive Blue 19 is C22H16N2Na2O11S3.
The molecular weight of Reactive Blue 19 is 625.9712 g/mol.
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