1-(2-Methylphenyl)cyclopropane-1-carbonitrile

Base Information

Chemical Name:1-(2-Methylphenyl)cyclopropane-1-carbonitrile
CAS No.:124276-51-3
Molecular Formula:C₁₁H₁₁N
Molecular Weight:157.215
Hs Code.:2926909090
DSSTox Substance ID:DTXSID60569784
Wikidata:Q82457007
Mol file:124276-51-3.mol

Synonyms:124276-51-3;1-(O-TOLYL)CYCLOPROPANECARBONITRILE;1-(2-METHYLPHENYL)CYCLOPROPANE-1-CARBONITRILE;1-(2-Methylphenyl)cyclopropanecarbonitrile;MFCD07374411;1-O-TOLYLCYCLOPROPANECARBONITRILE;SCHEMBL10528035;DTXSID60569784;1-o-tolyl-cyclopropanecarbonitrile;ZBRVAKYASUGIAX-UHFFFAOYSA-N;AKOS009266277;AB39393;SY226689;CS-0308902;EN300-139093;A926021

Suppliers and Price of 1-(2-Methylphenyl)cyclopropane-1-carbonitrile

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

Crysdot
1-(o-tolyl)Cyclopropanecarbonitrile 95+%
1g
$ 428.00

Chemenu
1-(o-tolyl)Cyclopropanecarbonitrile 95%
1g
$ 404.00

AK Scientific
1-(2-Methylphenyl)cyclopropane-1-carbonitrile
10g
$ 2416.00

AK Scientific
1-(2-Methylphenyl)cyclopropane-1-carbonitrile
1g
$ 637.00

Total 4 raw suppliers

Chemical Property of 1-(2-Methylphenyl)cyclopropane-1-carbonitrile

Chemical Property:

PSA：23.79000
LogP:2.55018
XLogP3:2.3
Hydrogen Bond Donor Count:0
Hydrogen Bond Acceptor Count:1
Rotatable Bond Count:1
Exact Mass:157.089149355
Heavy Atom Count:12
Complexity:218

Purity/Quality:

97% ^*data from raw suppliers

1-(o-tolyl)Cyclopropanecarbonitrile 95+% ^*data from reagent suppliers

Safty Information:

Pictogram(s):
Hazard Codes:

MSDS Files:: SDS file from LookChem

Useful:

Canonical SMILES:CC1=CC=CC=C1C2(CC2)C#N

Technology Process of 1-(2-Methylphenyl)cyclopropane-1-carbonitrile

There total 2 articles about 1-(2-Methylphenyl)cyclopropane-1-carbonitrile 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: 72.0%

: 95-46-5
2-methylphenyl bromide

: 5500-21-0
cyclopropropanecarbonitrile

: 124276-51-3
1-(o-tolyl)cyclopropanecarbonitrile

Guidance literature:: With tris-(dibenzylideneacetone)dipalladium⁽⁰⁾; 2,2'-bis-(diphenylphosphino)-1,1'-binaphthyl; lithium hexamethyldisilazane; In tetrahydrofuran; at 80 ℃; for 3h; Inert atmosphere;
DOI:10.1021/ol5030426

Reference yield: 67.0%

: 107-04-0
1-Bromo-2-chloroethane

: 22364-68-7
2-tolylmethylnitrile

: 124276-51-3
1-(o-tolyl)cyclopropanecarbonitrile

Guidance literature:: With N-benzyl-N,N,N-triethylammonium chloride; sodium hydroxide; In water; at 50 ℃;
DOI:10.1002/anie.201603153

Reference yield:

: 124276-51-3
1-(o-tolyl)cyclopropanecarbonitrile

: 886366-30-9
(1-(o-tolyl)cyclopropyl)methanol

Guidance literature:: Multi-step reaction with 2 steps

1: diisobutylaluminium hydride / dichloromethane; hexane / 2 h / -78 °C

2: sodium tetrahydroborate / methanol / 1 h / 20 °C

With sodium tetrahydroborate; diisobutylaluminium hydride; In methanol; hexane; dichloromethane;
DOI:10.1002/anie.201603153