Malononitrile, (3-trifluoromethylbenzylidene)-

Base Information

Chemical Name:Malononitrile, (3-trifluoromethylbenzylidene)-
CAS No.:36937-90-3
Molecular Formula:C11H5 F3 N2
Molecular Weight:222.169
Hs Code.:2926909090
DSSTox Substance ID:DTXSID50190425
Nikkaji Number:J147.663G
Mol file:36937-90-3.mol

Synonyms:36937-90-3;2-(3-Trifluorobenzylidene)-malononitrile;MALONONITRILE, (3-TRIFLUOROMETHYLBENZYLIDENE)-;3-(Trifluoromethyl)benzalmalononitrile;2-[[3-(trifluoromethyl)phenyl]methylidene]propanedinitrile;BRN 1967077;3-(Trifluoromethyl)benzylidenemalononitrile;2-{[3-(trifluoromethyl)phenyl]methylidene}propanedinitrile;SCHEMBL8103435;C11H5F3N2;DTXSID50190425;IAGXCFRBKLIQIR-UHFFFAOYSA-N;C11-H5-F3-N2;MCK103324;AKOS001112181;3-Trifluoromethylbenzylidenemalononitrile;LS-89015;2-(3-(trifluoromethyl)benzylidene)malononitrile;SR-01000203316;A1-00314;SR-01000203316-1;Z44300054

Suppliers and Price of Malononitrile, (3-trifluoromethylbenzylidene)-

Supply Marketing:

Business phase:: The product has achieved commercial mass production^*data from LookChem market partment

Manufacturers and distributors:

Manufacture/Brand
Chemicals and raw materials
Packaging
price

Matrix Scientific
2-(3-Trifluorobenzylidene)-malononitrile 97%
5g
$ 720.00

Matrix Scientific
2-(3-Trifluorobenzylidene)-malononitrile 97%
1g
$ 240.00

American Custom Chemicals Corporation
3-(TRIFLUOROMETHYL)BENZAL MALONONITRILE 95.00%
1G
$ 270.90

A1 Biochem Labs
2-(3-Trifluorobenzylidene)-malononitrile 97%
5 g
$ 450.00

Total 6 raw suppliers

Chemical Property of Malononitrile, (3-trifluoromethylbenzylidene)-

Chemical Property:

Vapor Pressure:0.00102mmHg at 25°C
Boiling Point:302°Cat760mmHg
Flash Point:136.5°C
PSA：47.58000
Density:1.33g/cm³
LogP:3.13596
XLogP3:3.1
Hydrogen Bond Donor Count:0
Hydrogen Bond Acceptor Count:5
Rotatable Bond Count:1
Exact Mass:222.04048265
Heavy Atom Count:16
Complexity:359

Purity/Quality:

99%+ ^*data from raw suppliers

2-(3-Trifluorobenzylidene)-malononitrile 97% ^*data from reagent suppliers

Safty Information:

Pictogram(s):
Hazard Codes:Xi

MSDS Files:: SDS file from LookChem

Useful:

Canonical SMILES:C1=CC(=CC(=C1)C(F)(F)F)C=C(C#N)C#N

Technology Process of Malononitrile, (3-trifluoromethylbenzylidene)-

There total 2 articles about Malononitrile, (3-trifluoromethylbenzylidene)- 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: 78.0%

: 454-89-7
3-Trifluoromethylbenzaldehyde

: 109-77-3
malononitrile

: 36937-90-3
3-(trifluoromethyl)-benzylidenemalononitrile

Guidance literature:: With piperidine; In ethanol; at 80 ℃; for 12h; Inert atmosphere;
DOI:10.1021/acs.orglett.9b00569

Reference yield:

: 36937-90-3
3-(trifluoromethyl)-benzylidenemalononitrile

Guidance literature:

Reference yield: 85.0%

: 23215-60-3
2-benzyl-2-phenylbenzothiazoline

: 36937-90-3
3-(trifluoromethyl)-benzylidenemalononitrile

: C₁₈H₁₃F₃N₂

Guidance literature:: With tris(bipyridine)ruthenium(II) dichloride hexahydrate; In 1,2-dichloro-ethane; at 20 ℃; for 24h; Irradiation;
DOI:10.1039/c9cc05336k