Ammonium,6-disulfo-1-naphthyl)benzylidene]-2,5-cyclohexadien-1-ylidene]dimethyl-, hydroxide, inner salt, sodium salt

Base Information

• Chemical Name: Ammonium,6-disulfo-1-naphthyl)benzylidene]-2,5-cyclohexadien-1-ylidene]dimethyl-, hydroxide, inner salt, sodium salt
• CAS No.: 3087-16-9
• Molecular Formula: C27H26 N2 O7 S2 . Na
• Molecular Weight: 577.66
• Hs Code.: 32041200
• NSC Number: 71959
• DSSTox Substance ID: DTXSID80859790
• Mol file: 3087-16-9.mol

Synonyms:C.I. Food Green 4;NSC-11237;NSC-71959;Ammonium,6-disulfo-1-naphthyl)benzylidene]-2,5-cyclohexadien-1-ylidene]dimethyl-, hydroxide, inner salt, sodium salt;Methanaminium,6-disulfo-1-naphthalenyl)methylene]-2,5-cyclohexadien-1-ylidene]-N-methyl-, hydroxide, inner salt, monosodium salt;NCIStruc1_000605;NCIStruc2_000970;SCHEMBL4805788;DTXSID80859790;NCI11237;NSC71959;CCG-37848;NCGC00013120;NCGC00013120-02;NCGC00096241-01;4-{[4-(Dimethylamino)phenyl](2-hydroxy-3,6-disulfonaphthalen-1-yl)methylidene}-N,N-dimethylcyclohexa-2,5-dien-1-iminium

Chemical Property of Ammonium,6-disulfo-1-naphthyl)benzylidene]-2,5-cyclohexadien-1-ylidene]dimethyl-, hydroxide, inner salt, sodium salt

Chemical Property:

• Appearance/Colour: solid
• PSA: 157.64000
• Density: 0.541[at 20℃]
• LogP: 5.22220
• Storage Temp.: Refrigerator
• Solubility.: DMSO (Slightly), Methanol (Slightly)
• Water Solubility.: 492.554g/L at 28℃
• XLogP3: 3.7
• Hydrogen Bond Donor Count: 3
• Hydrogen Bond Acceptor Count: 8
• Rotatable Bond Count: 5
• Exact Mass: 555.12596855
• Heavy Atom Count: 38
• Complexity: 1170

Purity/Quality:

99.9% ^*data from raw suppliers

Lissamine Green B ^*data from reagent suppliers

Safty Information:

• Pictogram(s): Xn
• Hazard Codes: Xn
• Statements: 22-36/37/38
• Safety Statements: 36/37/39

MSDS Files:

SDS file from LookChem

Useful:

• Canonical SMILES: CN(C)C1=CC=C(C=C1)C(=C2C=CC(=[N+](C)C)C=C2)C3=C4C=CC(=CC4=CC(=C3O)S(=O)(=O)O)S(=O)(=O)O
• Uses: Acid Green 50 is a food coloring in drinks and candles. Also used on living cells as protein stains for chemical and molecular analyses.