Tetrabromophenol Blue sodium salt

Base Information

• Chemical Name: Tetrabromophenol Blue sodium salt
• CAS No.: 108321-10-4
• Molecular Formula: C19H5Br8NaO5S
• Molecular Weight: 1007.53
• European Community (EC) Number: 600-863-9
• DSSTox Substance ID: DTXSID40399521
• Mol file: 108321-10-4.mol

Synonyms:Tetrabromophenol Blue sodium salt;108321-10-4;sodium;2,3,4,5-tetrabromo-6-[(3,5-dibromo-4-hydroxyphenyl)-(3,5-dibromo-4-oxocyclohexa-2,5-dien-1-ylidene)methyl]benzenesulfonate;SCHEMBL144418;4-benzyloxy phenol (Monobenzone);DTXSID40399521;3,3',3'',4,5,5',5'',6-Octabromophenolsulfonphthalein sodium salt;AKOS015964138;AKOS017345111;AC-29269;AC-29270;sodium 2,3,4,5-tetrabromo-6-[(3,5-dibromo-4-hydroxy-phenyl)-(3,5-dibromo-4-oxo-cyclohexa-2,5-dien-1-ylidene)methyl]benzenesulfonate;J-002095;Tetrabromophenol Blue sodium salt, Dye content 85 %;Sodium 2,3,4,5-tetrabromo-6-[(3,5-dibromo-4-hydroxyphenyl)-(3,5-dibromo-4-oxo-cyclohexa-2,5-dien-1-ylidene)methyl]benzenesulfonate

Chemical Property of Tetrabromophenol Blue sodium salt

Chemical Property:

• Melting Point: 203oC
• PKA: 5.69(at 25℃)
• PSA: 102.88000
• LogP: 9.89430
• Solubility.: Solubility Soluble in water, ethanol
• Hydrogen Bond Donor Count: 1
• Hydrogen Bond Acceptor Count: 5
• Rotatable Bond Count: 3
• Exact Mass: 1007.31404
• Heavy Atom Count: 34
• Complexity: 977

Purity/Quality:

98%, ^*data from raw suppliers

Tetrabromophenol Blue sodium salt Dye content 85% ^*data from reagent suppliers

Safty Information:

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

MSDS Files:

SDS file from LookChem

Useful:

• Canonical SMILES: C1=C(C=C(C(=C1Br)O)Br)C(=C2C=C(C(=O)C(=C2)Br)Br)C3=C(C(=C(C(=C3Br)Br)Br)Br)S(=O)(=O)[O-].[Na+]