(E)-4-(2-Nitrovinyl)benzonitrile

Base Information

Chemical Name:(E)-4-(2-Nitrovinyl)benzonitrile
CAS No.:5153-73-1
Molecular Formula:C₉H₆N₂O₂
Molecular Weight:174.159
Hs Code.:2926907090
European Community (EC) Number:678-300-1
Nikkaji Number:J1.234.148B,J316.177C
Pharos Ligand ID:F857FGJVKWDX
ChEMBL ID:CHEMBL4593275
Mol file:5153-73-1.mol

Synonyms:(E)-4-(2-Nitrovinyl)benzonitrile;5153-73-1;1-(4-Cyanophenyl)-2-nitroethene;trans-4-(2-Nitroethenyl)benzonitrile;4-[(E)-2-nitroethenyl]benzonitrile;4-(2-nitroethenyl)benzonitrile;Benzonitrile, 4-(2-nitroethenyl)-, (E)-;CHEMBL4593275;4-[(E)-2-nitrovinyl]benzonitrile;SCHEMBL4579653;HMS562A13;CVWPMONBGNBYCJ-AATRIKPKSA-N;BDBM512800;3156-42-1;acs.jmedchem.1c00409_ST.395;trans-4-(2-Nitrovinyl)benzonitrile;Benzonitrile, 4-(2-nitroethenyl)-;BDBM50504454;CK2136;MFCD00176174;AKOS010878665;AKOS017433890;AS-45868;PD168619;4-((1E)-2-nitro-1-ethenyl)benzonitrile;CS-0313506;N0708;EN300-1839481;A871245

Suppliers and Price of (E)-4-(2-Nitrovinyl)benzonitrile

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

TCI Chemical
trans-4-(2-Nitroethenyl)benzonitrile >98.0%(GC)
1g
$ 189.00

Crysdot
(E)-4-(2-Nitrovinyl)benzonitrile 95+%
5g
$ 317.00

Crysdot
(E)-4-(2-Nitrovinyl)benzonitrile 95+%
1g
$ 94.00

Biosynth Carbosynth
1-(4-Cyanophenyl)-2-nitroethene
10 g
$ 125.00

Biosynth Carbosynth
1-(4-Cyanophenyl)-2-nitroethene
5 g
$ 75.00

Biosynth Carbosynth
1-(4-Cyanophenyl)-2-nitroethene
25 g
$ 250.00

American Custom Chemicals Corporation
1-(4-CYANOPHENYL)-2-NITROETHENE 95.00%
5MG
$ 498.11

Alichem
4-(2-Nitroethenyl)benzonitrile
25g
$ 760.79

Alichem
4-(2-Nitroethenyl)benzonitrile
5g
$ 253.65

Alichem
4-(2-Nitroethenyl)benzonitrile
10g
$ 422.43

Total 21 raw suppliers

Chemical Property of (E)-4-(2-Nitrovinyl)benzonitrile

Chemical Property:

Vapor Pressure:3.56E-05mmHg at 25°C
Melting Point:187 °C
Refractive Index:1.586
Boiling Point:353.5 °C at 760 mmHg
Flash Point:167.6 °C
PSA：69.61000
Density:1.25
LogP:2.32888
Storage Temp.:Sealed in dry,Room Temperature
XLogP3:1.5
Hydrogen Bond Donor Count:0
Hydrogen Bond Acceptor Count:3
Rotatable Bond Count:1
Exact Mass:174.042927438
Heavy Atom Count:13
Complexity:251

Purity/Quality:

98% ^*data from raw suppliers

trans-4-(2-Nitroethenyl)benzonitrile >98.0%(GC) ^*data from reagent suppliers

Safty Information:

Pictogram(s):
Hazard Codes:
Statements: 20/21/22
Safety Statements: 36/37/39

MSDS Files:: SDS file from LookChem

Useful:

Canonical SMILES:C1=CC(=CC=C1C=C[N+](=O)[O-])C#N
Isomeric SMILES:C1=CC(=CC=C1/C=C/[N+](=O)[O-])C#N

Technology Process of (E)-4-(2-Nitrovinyl)benzonitrile

There total 8 articles about (E)-4-(2-Nitrovinyl)benzonitrile 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: 87.0%

: 3156-42-1,5153-73-1
4-[(E)-2-nitroethenyl]benzonitrile

Guidance literature:: With chloro-trimethyl-silane; copper(ll) sulfate pentahydrate; guanidine nitrate; In acetonitrile; at 0 - 20 ℃; Inert atmosphere;

With triethylamine; In acetonitrile; at 20 ℃; for 0.416667h; stereoselective reaction; Inert atmosphere;

Reference yield: 84.0%

: 3435-51-6
4-ethenylbenzonitrile

: 3156-42-1,5153-73-1
4-[(E)-2-nitroethenyl]benzonitrile

Guidance literature:: With tert.-butylnitrite; 2,2,6,6-Tetramethyl-1-piperidinyloxy free radical; In 1,4-dioxane; at 90 ℃; for 12h; stereoselective reaction;
DOI:10.1021/ol401426p