2-Amino-6-(trifluoromethyl)nicotinaldehyde

Base Information

• Chemical Name: 2-Amino-6-(trifluoromethyl)nicotinaldehyde
• CAS No.: 890302-67-7
• Molecular Formula: C₇H₅F₃N₂O
• Molecular Weight: 190.125
• European Community (EC) Number: 891-460-9
• Mol file: 890302-67-7.mol

Synonyms:2-AMINO-6-(TRIFLUOROMETHYL)NICOTINALDEHYDE;890302-67-7;2-amino-6-(trifluoromethyl)pyridine-3-carbaldehyde;2-amino-6-trifluoromethylpyridine-3-carboxaldehyde;SCHEMBL125558;AKOS006304818;AB56796;CS-0235718;EN300-1602354;Z1198276260

Chemical Property of 2-Amino-6-(trifluoromethyl)nicotinaldehyde

Chemical Property:

• XLogP3: 1.4
• Hydrogen Bond Donor Count: 1
• Hydrogen Bond Acceptor Count: 6
• Rotatable Bond Count: 1
• Exact Mass: 190.03539727
• Heavy Atom Count: 13
• Complexity: 195

Purity/Quality:

98%min ^*data from raw suppliers

2-Amino-6-(trifluoromethyl)nicotinaldehyde ^*data from reagent suppliers

Safty Information:

• Pictogram(s):  
• Hazard Codes: 

MSDS Files:

Useful:

• Canonical SMILES: C1=CC(=NC(=C1C=O)N)C(F)(F)F

Technology Process of 2-Amino-6-(trifluoromethyl)nicotinaldehyde

There total 4 articles about 2-Amino-6-(trifluoromethyl)nicotinaldehyde 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:

2-amino-6-trifluoromethyl-pyridin-3-yl-methanol (890302-66-6) → 2-amino-6-trifluoromethylpyridine-3-carboxaldehyde (890302-67-7)

Guidance literature:

With manganese(IV) oxide; In dichloromethane; at 40 ℃;

DOI:10.1016/j.bmcl.2012.08.094

Reference yield:

methyl 2-bromo-6-(trifluoromethyl)nicotinate (144740-56-7) → 2-amino-6-trifluoromethylpyridine-3-carboxaldehyde (890302-67-7)

Guidance literature:

Multi-step reaction with 3 steps

1: Benzophenone imine; caesium carbonate / palladium diacetate; 4,5-bis(diphenylphosphino)-9,9-dimethylxanthene / 1,4-dioxane / 0.5 h / 150 °C / Microwave irradiation

2: lithium aluminium tetrahydride / tetrahydrofuran / 2 h / 0 °C

3: manganese(IV) oxide / chloroform / 3 h / 20 °C

With Benzophenone imine; manganese(IV) oxide; lithium aluminium tetrahydride; caesium carbonate; palladium diacetate; 4,5-bis(diphenylphosphino)-9,9-dimethylxanthene; In tetrahydrofuran; 1,4-dioxane; chloroform;

Reference yield:

ethyl 2-amino-6-(trifluoromethyl)nicotinate → 2-amino-6-trifluoromethylpyridine-3-carboxaldehyde (890302-67-7)

Guidance literature:

Multi-step reaction with 2 steps

1: lithium aluminium tetrahydride / diethyl ether / 0 °C

2: manganese(IV) oxide / dichloromethane / 40 °C

With manganese(IV) oxide; lithium aluminium tetrahydride; In diethyl ether; dichloromethane;

DOI:10.1016/j.bmcl.2012.08.094

upstream raw materials:

2-amino-6-trifluoromethyl-pyridin-3-yl-methanol

methyl 2-amino-6-(trifluoromethyl)nicotinate

methyl 2-bromo-6-(trifluoromethyl)nicotinate