4,4'-Bis(dimethylamino)-4''-(methylamino)trityl alcohol

Base Information

• Chemical Name: 4,4'-Bis(dimethylamino)-4''-(methylamino)trityl alcohol
• CAS No.: 561-41-1
• Molecular Formula: C24H29 N3 O
• Molecular Weight: 375.514
• European Community (EC) Number: 209-218-2
• DSSTox Substance ID: DTXSID00204642
• Nikkaji Number: J39.700H
• Mol file: 561-41-1.mol

Synonyms:561-41-1;4,4'-Bis(dimethylamino)-4''-(methylamino)trityl alcohol;EINECS 209-218-2;bis[4-(dimethylamino)phenyl]-[4-(methylamino)phenyl]methanol;C24H29N3O;DTXSID00204642;EC 209-218-2;alpha,alpha-Bis[4-(dD471285imethylamino)phenyl]-4-(methylamino)-benzenemethanol (>75per cent);alpha,alpha-Bis[4-(dimethylamino)phenyl]-4-(methylamino)benzenemethanol;C.I.Solvent Violet 8;SCHEMBL20561184;AKOS027257545;Benzenemethanol, alpha,alpha-bis(4-(dimethylamino)phenyl)-4-(methylamino)-;alpha,alpha-Bis[4-(dD471285imethylamino)phenyl]-4-(methylamino)-benzenemethanol (>75%);4,4'-bis(dimethylamino)-4''-(methylamino)trityl alcohol;bis[4-(dimethylamino)phenyl][4-(methylamino)phenyl]methanol;4,4'-bis(dimethylamino)-4''-(methylamino)trityl alcohol bis[4-(dimethylamino)phenyl][4-(methylamino)phenyl]methanol

Chemical Property of 4,4'-Bis(dimethylamino)-4''-(methylamino)trityl alcohol

Chemical Property:

• Vapor Pressure: 0Pa at 25℃
• Boiling Point: 575.3°Cat760mmHg
• PKA: 14.31±0.29(Predicted)
• Flash Point: 301.7°C
• PSA: 38.74000
• Density: 1.152g/cm³
• LogP: 4.21750
• Storage Temp.: Amber Vial, -20°C Freezer, Under inert atmosphere
• Solubility.: DMSO (Slightly), Methanol (Slightly)
• Water Solubility.: 14.01-90mg/L at 25-30℃
• XLogP3: 4.4
• Hydrogen Bond Donor Count: 2
• Hydrogen Bond Acceptor Count: 4
• Rotatable Bond Count: 6
• Exact Mass: 375.231062557
• Heavy Atom Count: 28
• Complexity: 429

Purity/Quality:

99.9% ^*data from raw suppliers

α,α-Bis[4-(dimethylamino)phenyl]-4-(methylamino)-benzenemethanol(TechnicalGrade) ^*data from reagent suppliers

Safty Information:

• Pictogram(s):  
• Hazard Codes: 

MSDS Files:

SDS file from LookChem

Useful:

• Canonical SMILES: CNC1=CC=C(C=C1)C(C2=CC=C(C=C2)N(C)C)(C3=CC=C(C=C3)N(C)C)O
• Uses: α,α-Bis[4-(dimethylamino)phenyl]-4-(methylamino)-benzenemethanol is a product from degradation of methyl green.

Technology Process of 4,4'-Bis(dimethylamino)-4''-(methylamino)trityl alcohol

There total 4 articles about 4,4'-Bis(dimethylamino)-4''-(methylamino)trityl alcohol which guide to synthetic route it. The literature collected by LookChem mainly comes from the sharing of users and the free literature resources found by Internet computing technology. We keep the original model of the professional version of literature to make it easier and faster for users to retrieve and use. At the same time, we analyze and calculate the most feasible synthesis route with the highest yield for your reference as below:

synthetic route:

Reference yield:

methyl violet (603-47-4,71143-08-3) → [4-(N,N-dimethylamino)][4'-(N',N'-dimethylamino)][4''-(N''-methylamino)]triphenylmethanol (561-41-1)

Guidance literature:

With sodium docusate; sodium hydroxide; In water; at 34.84 ℃; Temperature; Reagent/catalyst; Kinetics;

DOI:10.1002/kin.21528

Reference yield:

4,4'-bis dimethylamino 4''-monomethylamino triphenyl carbocation (18454-19-8) → [4-(N,N-dimethylamino)][4'-(N',N'-dimethylamino)][4''-(N''-methylamino)]triphenylmethanol (561-41-1)

Guidance literature:

With water; In phosphate buffer; at 35 ℃; pH=5.72; Further Variations:; pH-values; Kinetics; Equilibrium constant;

Reference yield:

methyl violet 2B (71143-08-3) → [4-(N,N-dimethylamino)][4'-(N',N'-dimethylamino)][4''-(N''-methylamino)]triphenylmethanol (561-41-1)

Guidance literature:

With hydroxide; In water; Equilibrium constant; Rate constant;

upstream raw materials:

methyl violet 2B

4,4'-bis dimethylamino 4''-monomethylamino triphenyl carbocation

methyl violet

Downstream raw materials:

methyl violet 2B

Refernces

• 1、 Sen Gupta,Mishra,Radha Rani. "A study on equilibrium and kinetics of carbocation-to-carbinol conversion for di- and tri- arylmethane dye cations in aqueous solutions: Relative stabilities of dye carbocations and mechanism of dye carbinol formation". . p. 703 - 708. Retrieved 2007/10/03.