5,5'-(3H-2,1-Benzoxathiol-3-ylidene)bis(3-methylsalicylic) acid S,S-dioxide, sodium salt

Base Information

• Chemical Name: 5,5'-(3H-2,1-Benzoxathiol-3-ylidene)bis(3-methylsalicylic) acid S,S-dioxide, sodium salt
• CAS No.: 3564-18-9
• Molecular Formula: C23H15Na3O9S
• Molecular Weight: 536.39
• Hs Code.: 32041900
• European Community (EC) Number: 280-847-2
• NSC Number: 112257
• Mol file: 3564-18-9.mol

Synonyms:EINECS 280-847-2;NSC112257;5,5'-(3H-2,1-Benzoxathiol-3-ylidene)bis(3-methylsalicylic) acid S,S-dioxide, sodium salt;83784-16-1;NSC-112257;5,5'-(3H-2,1-benzoxathiol-3-ylidene)bis[3-methylsalicylic] acid S,S-dioxide, sodium salt;C23H18O9S.xNa;C23-H18-O9-S.x-Na;FT-0625690;D90459;Benzoic acid,5-cyclohexadien-1-ylidene)(2-sulfophenyl)methyl]-2-hydroxy-3-methyl-, trisodium salt

Chemical Property of 5,5'-(3H-2,1-Benzoxathiol-3-ylidene)bis(3-methylsalicylic) acid S,S-dioxide, sodium salt

Chemical Property:

• Appearance/Colour: reddish blue powder
• PSA: 183.14000
• LogP: 1.05620
• Storage Temp.: Store at +5°C to +30°C.
• Solubility.: 420g/l
• Water Solubility.: Soluble in water
• Hydrogen Bond Donor Count: 4
• Hydrogen Bond Acceptor Count: 9
• Rotatable Bond Count: 4
• Exact Mass: 493.05692260
• Heavy Atom Count: 34
• Complexity: 839

Purity/Quality:

98% ^*data from raw suppliers

Eriochrome Cyanine R ^*data from reagent suppliers

Safty Information:

• Pictogram(s): Xi
• Hazard Codes: Xi
• Statements: 36/37/38
• Safety Statements: 26-36-36/37-24/25

MSDS Files:

SDS file from LookChem

Total 1 MSDS from other Authors

Useful:

• Canonical SMILES: CC1=CC(=CC(=C1O)C(=O)O)C2(C3=CC=CC=C3S(=O)(=O)O2)C4=CC(=C(C(=C4)C)O)C(=O)O.[Na+]
• Uses: Chromoxane Cyanine R is a dye for metal detection.