Leuco Malachite Green-d5

Base Information

• Chemical Name: Leuco Malachite Green-d5
• CAS No.: 947601-82-3
• Molecular Formula: C₂₃H₂₆N₂
• Molecular Weight: 336.425
• European Community (EC) Number: 635-453-9
• DSSTox Substance ID: DTXSID50583590
• Wikidata: Q82475177
• Mol file: 947601-82-3.mol

Synonyms:Leuco Malachite Green-d5;Leucomalachite Green-d5;947601-82-3;Bis-(4-dimethylaminophenyl)phenyl-d5-methane;4-[[4-(dimethylamino)phenyl]-(2,3,4,5,6-pentadeuteriophenyl)methyl]-N,N-dimethylaniline;LMG-D5;HY-D0300S;DTXSID50583590;Leucomalachite green D5 (phenyl D5);CS-0213816;Leucomalachite Green-d5, analytical standard;Leucomalachite Green-d5, 97 atom % D, 97% (CP);Benzenamine, 4,4'-(phenyl-2,3,4,5,6-d5-methylene)bis[N,N-dimethyl-;Leucomalachite Green (phenyl-D5)

Chemical Property of Leuco Malachite Green-d5

Chemical Property:

• Boiling Point: 475.4oC at 760 mmHg
• Flash Point: 214.6oC
• PSA: 6.48000
• Density: 1.086g/cm3
• LogP: 4.99880
• Storage Temp.: Refrigerator, Under inert atmosphere
• Solubility.: Chloroform (Slightly), DMSO (Slightly)
• XLogP3: 5.3
• Hydrogen Bond Donor Count: 0
• Hydrogen Bond Acceptor Count: 2
• Rotatable Bond Count: 5
• Exact Mass: 335.240982568
• Heavy Atom Count: 25
• Complexity: 342

Purity/Quality:

99% ^*data from raw suppliers

Leucomalachite Green-d5 ^*data from reagent suppliers

Safty Information:

• Pictogram(s): Xn,N
• Hazard Codes: Xn,N
• Statements: 22-50/53
• Safety Statements: 60-61

MSDS Files:

SDS file from LookChem

Useful:

• Canonical SMILES: CN(C)C1=CC=C(C=C1)C(C2=CC=CC=C2)C3=CC=C(C=C3)N(C)C
• Isomeric SMILES: [2H]C1=C(C(=C(C(=C1[2H])[2H])C(C2=CC=C(C=C2)N(C)C)C3=CC=C(C=C3)N(C)C)[2H])[2H]
• Uses: A labelled metabolite of Malachite Green A labelled metabolite of Malachite Green in seafood products. A labelled triphenylmethane dye with fungicidal and limited antiseptic activity. The term Malachine green applies to the oxalate as well as the chloride. Harmful if swallowed. Avoid release to the environment.

Technology Process of Leuco Malachite Green-d5

There total 2 articles about Leuco Malachite Green-d5 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: 65.0%

benzaldehyde-d6 (17901-93-8) + N,N-dimethyl-aniline (121-69-7,77733-26-7) → leucomalachite green-d6 (1173021-13-0,947601-82-3)

Guidance literature:

With antimony(III) chloride; at 120 ℃; for 4h;

Reference yield:

(2)H8-toluene (2037-26-5) → leucomalachite green-d6 (1173021-13-0,947601-82-3)

Guidance literature:

Multi-step reaction with 3 steps

1: sulfuric acid; chromium(VI) oxide / 0.17 h / 0 - 10 °C

2: sulfuric acid / ethanol / 0.5 h / Reflux

3: antimony(III) chloride / 4 h / 120 °C

With chromium(VI) oxide; sulfuric acid; antimony(III) chloride; In ethanol;

upstream raw materials:

⁽²⁾H₈-toluene

benzaldehyde-d6

N,N-dimethyl-aniline

Refernces