[3-Methyl-2-(propan-2-yl)phenyl]acetonitrile

Base Information

Chemical Name:[3-Methyl-2-(propan-2-yl)phenyl]acetonitrile
CAS No.:58050-29-6
Molecular Formula:C12H15N
Molecular Weight:173.2542
Hs Code.:
DSSTox Substance ID:DTXSID60482242
Wikidata:Q82318376
Mol file:58050-29-6.mol

Synonyms:58050-29-6;[3-Methyl-2-(propan-2-yl)phenyl]acetonitrile;DTXSID60482242

Suppliers and Price of [3-Methyl-2-(propan-2-yl)phenyl]acetonitrile

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

Total 3 raw suppliers

Chemical Property of [3-Methyl-2-(propan-2-yl)phenyl]acetonitrile

Chemical Property:

PSA：23.79000
LogP:3.18448
XLogP3:3.1
Hydrogen Bond Donor Count:0
Hydrogen Bond Acceptor Count:1
Rotatable Bond Count:2
Exact Mass:173.120449483
Heavy Atom Count:13
Complexity:198

Purity/Quality:: 99% ^*data from raw suppliers

Safty Information:

Pictogram(s):
Hazard Codes:

MSDS Files:

Useful:

Canonical SMILES:CC1=C(C(=CC=C1)CC#N)C(C)C

Technology Process of [3-Methyl-2-(propan-2-yl)phenyl]acetonitrile

There total 3 articles about [3-Methyl-2-(propan-2-yl)phenyl]acetonitrile 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:

: 14411-75-7
2-isopropyl-1,3-dimethylbenzene

: 58050-29-6
2-Isopropyl-3-methyl-benzylcyanid

Guidance literature:: Multi-step reaction with 2 steps

1: NBS, (PhCO)2O₂

2: KI

With N-Bromosuccinimide; potassium iodide; dibenzoyl peroxide;

Reference yield:

: 339363-93-8
2-Isopropyl-1,3-dimethylcyclohexadien

: 58050-29-6
2-Isopropyl-3-methyl-benzylcyanid

Guidance literature:: Multi-step reaction with 3 steps

1: sulfur / 210 - 220 °C

2: NBS, (PhCO)2O₂

3: KI

With N-Bromosuccinimide; sulfur; potassium iodide; dibenzoyl peroxide;