3-Ethoxybenzonitrile

Base Information

Chemical Name:3-Ethoxybenzonitrile
CAS No.:25117-75-3
Molecular Formula:C9H9 N O
Molecular Weight:147.177
Hs Code.:2926909090
European Community (EC) Number:246-632-2
DSSTox Substance ID:DTXSID60179807
Nikkaji Number:J103.210K
Wikidata:Q83050325
Mol file:25117-75-3.mol

Synonyms:3-Ethoxybenzonitrile;25117-75-3;Benzonitrile, 3-ethoxy-;Benzonitrile, m-ethoxy-;3-ethoxy-benzonitrile;EINECS 246-632-2;MFCD00001805;m-Ethoxy benzonitrile;3-Ethoxybenzoic acid nitrile;SCHEMBL1821556;DTXSID60179807;AMY28499;AKOS000198122;FS-4602;SY061633;CS-0159909;FT-0682168;EN300-09450;D95712;J-015818;Z54464104

Suppliers and Price of 3-Ethoxybenzonitrile

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

TRC
3-Ethoxybenzonitrile
1g
$ 75.00

SynQuest Laboratories
3-Ethoxybenzonitrile 98%
1 g
$ 49.00

SynQuest Laboratories
3-Ethoxybenzonitrile 98%
25 g
$ 389.00

SynQuest Laboratories
3-Ethoxybenzonitrile 98%
5 g
$ 98.00

Matrix Scientific
3-Ethoxybenzonitrile 98%
50g
$ 598.00

Matrix Scientific
3-Ethoxybenzonitrile 98%
10g
$ 151.00

Crysdot
3-Ethoxybenzonitrile 95+%
100g
$ 351.00

American Custom Chemicals Corporation
3-ETHOXYBENZONITRILE 95.00%
50G
$ 2967.20

American Custom Chemicals Corporation
3-ETHOXYBENZONITRILE 95.00%
10G
$ 1204.67

Alfa Aesar
3-Ethoxybenzonitrile, 95%
25g
$ 189.00

Total 20 raw suppliers

Chemical Property of 3-Ethoxybenzonitrile

Chemical Property:

Vapor Pressure:0.0435mmHg at 25°C
Refractive Index:n20/D 1.529(lit.)
Boiling Point:238°Cat760mmHg
Flash Point:98.6°C
PSA：33.02000
Density:1.05g/cm³
LogP:1.95698
Storage Temp.:2-8°C
XLogP3:2.1
Hydrogen Bond Donor Count:0
Hydrogen Bond Acceptor Count:2
Rotatable Bond Count:2
Exact Mass:147.068413911
Heavy Atom Count:11
Complexity:158

Purity/Quality:

99%, ^*data from raw suppliers

3-Ethoxybenzonitrile ^*data from reagent suppliers

Safty Information:

Pictogram(s): Xn
Hazard Codes:Xn
Statements: 20/21/22
Safety Statements: 36

MSDS Files:: SDS file from LookChem

Useful:

Canonical SMILES:CCOC1=CC=CC(=C1)C#N

Technology Process of 3-Ethoxybenzonitrile

There total 8 articles about 3-Ethoxybenzonitrile 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: 93.0%

: 25117-75-3
3-(ethyloxy)benzonitrile

Guidance literature:: With sodium hydride; In N,N-dimethyl-formamide; mineral oil; at 10 - 35 ℃; for 0.75h;

In N,N-dimethyl-formamide; mineral oil; at 10 - 90 ℃; for 13h;

Reference yield: 90.0%

: potassiumhexacyanoferrate(II) trihydrate

: 2655-83-6
1-chloro-3-ethoxybenzene

: 25117-75-3
3-(ethyloxy)benzonitrile

Guidance literature:: With 2-[2-(dicyclohexylphosphino)-phenyl]-1-methyl-1H-indole; palladium diacetate; sodium carbonate; triethylamine; In water; acetonitrile; at 70 ℃; for 18h;
DOI:10.1021/ol1028892