N-(4-{bis[4-(dimethylamino)phenyl]methylidene}cyclohexa-2,5-dien-1-ylidene)methanaminium

Base Information

• Chemical Name: N-(4-{bis[4-(dimethylamino)phenyl]methylidene}cyclohexa-2,5-dien-1-ylidene)methanaminium
• CAS No.: 8004-87-3
• Deprecated CAS: 12227-76-8,12634-45-6,1335-69-9,4353-72-4,8048-69-9,134191-03-0
• Molecular Formula: C24H28ClN3
• Molecular Weight: 393.96
• Hs Code.: 3204.13 DERIVATION
• European Community (EC) Number: 616-345-0
• DSSTox Substance ID: DTXSID50868814,DTXSID201174432
• Nikkaji Number: J245.614A,J742.503A
• Mol file: 8004-87-3.mol

Synonyms:Basic Violet 1;CI 42535

Chemical Property of N-(4-{bis[4-(dimethylamino)phenyl]methylidene}cyclohexa-2,5-dien-1-ylidene)methanaminium

Chemical Property:

• Appearance/Colour: green crystalline powder with metal lustre
• Vapor Pressure: 1.04E-10mmHg at 25°C
• Melting Point: 137 °C
• Refractive Index: 1.639
• Boiling Point: 532.2 °C at 760 mmHg
• Flash Point: 275.7 °C
• PSA: 20.45000
• Density: 1.089g/cm³
• LogP: -0.09810
• Solubility.: Solubility Soluble in water, ethanol, chloroform; insoluble in e
• Water Solubility.: soluble
• XLogP3: 4.8
• Hydrogen Bond Donor Count: 1
• Hydrogen Bond Acceptor Count: 2
• Rotatable Bond Count: 4
• Exact Mass: 358.228322906
• Heavy Atom Count: 27
• Complexity: 561

Purity/Quality:

99% ^*data from raw suppliers

BasicViolet1(TechnicalGrade) ^*data from reagent suppliers

Safty Information:

• Pictogram(s): Xn
• Hazard Codes: Xn,N
• Statements: 22-36-50-40
• Safety Statements: 26-36-24/25-22-61-36/37

MSDS Files:

SDS file from LookChem

Useful:

• Canonical SMILES: CNC1=CC=C(C=C1)C(=C2C=CC(=[N+](C)C)C=C2)C3=CC=C(C=C3)N(C)C
• Uses: Medicine (topical antibacterial and antialler-gen), acid–base indicator, alcohol denaturant, bio-logical stain, textile dye. Methyl violet 2B is a biological stain that is commonly used at a pH between 0 and 1.6. It is certified for use in Flemming triple stain with iodine for chromosomes; Newton?s crystal violet-iodine technique for chromatin and nucleoli; Lieb?s amyloid stain.