(4-((2-Chlorophenyl)(4-(ethyl((3-sulphonatophenyl)methyl)ammonio)phenyl)methylene)cyclohexa-2,5-dien-1-ylidene)(ethyl)(3-sulphonatobenzyl)ammonium

Base Information

• Chemical Name: (4-((2-Chlorophenyl)(4-(ethyl((3-sulphonatophenyl)methyl)ammonio)phenyl)methylene)cyclohexa-2,5-dien-1-ylidene)(ethyl)(3-sulphonatobenzyl)ammonium
• CAS No.: 25305-97-9
• Molecular Formula: C37H35 Cl N2 O6 S2
• Molecular Weight: 703.2666
• European Community (EC) Number: 246-804-7
• UNII: 0KZJ2ILK5W
• DSSTox Substance ID: DTXSID501099796
• Mol file: 25305-97-9.mol

Synonyms:25305-97-9;Acid Green 9 free acid;0KZJ2ILK5W;ALIZARIN GREEN;3-(((4-((2-Chlorophenyl)(4-(ethyl(3-sulfobenzyl)amino)phenyl)methylene)cyclohexa-2,5-dien-1-ylidene)(ethyl)ammonio)methyl)benzenesulfonate;BENZENEMETHANAMINIUM, N-(4-((2-CHLOROPHENYL)(4-(ETHYL((3-SULFOPHENYL)METHYL)AMINO)PHENYL)METHYLENE)-2,5-CYCLOHEXADIEN-1-YLIDENE)-N-ETHYL-3-SULFO-, INNER SALT;Benzenemethanaminium, N-[4-[(2-chlorophenyl)[4-[ethyl[(3-sulfophenyl)methyl]amino]phenyl]methylene]-2,5-cyclohexadien-1-ylidene]-N-ethyl-3-sulfo-, inner salt;EINECS 246-804-7;UNII-0KZJ2ILK5W;ACILAN TURQUOISE BLUE B;DTXSID501099796;C.I. ACID GREEN 9 FREE ACID;(4-((2-Chlorophenyl)(4-(ethyl((3-sulphonatophenyl)methyl)ammonio)phenyl)methylene)cyclohexa-2,5-dien-1-ylidene)(ethyl)(3-sulphonatobenzyl)ammonium

Chemical Property of (4-((2-Chlorophenyl)(4-(ethyl((3-sulphonatophenyl)methyl)ammonio)phenyl)methylene)cyclohexa-2,5-dien-1-ylidene)(ethyl)(3-sulphonatobenzyl)ammonium

Chemical Property:

• Boiling Point: °Cat760mmHg
• Flash Point: °C
• PSA: 172.62000
• Density: g/cm³
• LogP: 8.25040
• XLogP3: 6.6
• Hydrogen Bond Donor Count: 1
• Hydrogen Bond Acceptor Count: 7
• Rotatable Bond Count: 10
• Exact Mass: 702.1625069
• Heavy Atom Count: 48
• Complexity: 1400

Purity/Quality:

99% ^*data from raw suppliers

Safty Information:

• Pictogram(s):  
• Hazard Codes: 

MSDS Files:

SDS file from LookChem

Useful:

• Canonical SMILES: CCN(CC1=CC(=CC=C1)S(=O)(=O)[O-])C2=CC=C(C=C2)C(=C3C=CC(=[N+](CC)CC4=CC(=CC=C4)S(=O)(=O)O)C=C3)C5=CC=CC=C5Cl