3-(1H-Pyrrol-1-yl)propanenitrile

Base Information

Chemical Name:3-(1H-Pyrrol-1-yl)propanenitrile
CAS No.:43036-06-2
Molecular Formula:C7H8N2
Molecular Weight:120.154
Hs Code.:29339900
European Community (EC) Number:256-051-6
NSC Number:78437
DSSTox Substance ID:DTXSID00195647
Nikkaji Number:J364.722F
Wikidata:Q83068663
Mol file:43036-06-2.mol

Synonyms:43036-06-2;3-(1H-Pyrrol-1-yl)propanenitrile;N-(2-cyanoethyl)pyrrole;1-(2-Cyanoethyl)pyrrole;1H-Pyrrole-1-propanenitrile;Pyrrole-1-propionitrile;3-pyrrol-1-ylpropanenitrile;3-(Pyrrol-1-yl)propiononitrile;N-(2-Cyanoethyl)-pyrrole;EINECS 256-051-6;MFCD00003092;N-cyanoethylpyrrole;NSC78437;1-Pyrrolepropionitrile;N-(2-cyanoethyl)pyrole;3-pyrrol-1-yl-propionitrile;3-(1-Pyrrolyl)propionitrile;SCHEMBL536224;3-(1-pyrrolyl) propionitrile;1-(2-Cyanoethyl)-1H-pyrrole;DTXSID00195647;CHEBI:194812;1-(2-Cyanoethyl)pyrrole, >=99%;NSC 78437;NSC-78437;3-(1H-Pyrrol-1-yl)propanenitrile #;AKOS015898303;CS-W021753;GS-6571;SB62116;SY011924;FT-0613500;EN300-115981;H10352;A872770;115112-01-1

Suppliers and Price of 3-(1H-Pyrrol-1-yl)propanenitrile

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
1H-Pyrrole-1-propanenitrile
5g
$ 155.00

SynQuest Laboratories
N-(2-Cyanoethyl)pyrrole 95%
25 g
$ 336.00

SynQuest Laboratories
N-(2-Cyanoethyl)pyrrole 95%
100 g
$ 1024.00

SynQuest Laboratories
N-(2-Cyanoethyl)pyrrole 95%
5 g
$ 144.00

Sigma-Aldrich
1-(2-Cyanoethyl)pyrrole ≥99%
25g
$ 164.00

Medical Isotopes, Inc.
1H-Pyrrole-1-propanenitrile
5 g
$ 640.00

Frontier Specialty Chemicals
N-(2-Cyanoethyl)pyrrole 97%
5g
$ 36.00

Crysdot
3-(1H-Pyrrol-1-yl)propanenitrile 98%
100g
$ 212.00

Chemenu
3-(1H-Pyrrol-1-yl)propanenitrile 95%+
100g
$ 268.00

Chemenu
3-(1H-Pyrrol-1-yl)propanenitrile 95%+
25g
$ 72.00

Total 46 raw suppliers

Chemical Property of 3-(1H-Pyrrol-1-yl)propanenitrile

Chemical Property:

Appearance/Colour:clear slightly yellow to brown liquid
Vapor Pressure:0.00846mmHg at 25°C
Refractive Index:n20/D 1.51(lit.)
Boiling Point:266.8 °C at 760 mmHg
PKA:-3.80±0.70(Predicted)
Flash Point:104.4 °C
PSA：28.72000
Density:0.96 g/cm³
LogP:1.40178
Storage Temp.:Sealed in dry,Room Temperature
Solubility.:Chloroform
XLogP3:0.3
Hydrogen Bond Donor Count:0
Hydrogen Bond Acceptor Count:1
Rotatable Bond Count:2
Exact Mass:120.068748264
Heavy Atom Count:9
Complexity:116

Purity/Quality:

97% ^*data from raw suppliers

1H-Pyrrole-1-propanenitrile ^*data from reagent suppliers

Safty Information:

Pictogram(s): Xn
Hazard Codes:Xn
Statements: 20/21/22-36/37/38
Safety Statements: 26-37/39

MSDS Files:

SDS file from LookChem

Total 1 MSDS from other Authors

Useful:

Canonical SMILES:C1=CN(C=C1)CCC#N
Uses N-(2-CYANOETHYL)PYRROLE is used in the synthesis of 2-pyridines. It is also used in the preparation of indoles/pyrroles. 1H-Pyrrole-1-propanenitrile is used in the synthesis of 2-pyridines. It is also used in the preparation of indoles/pyrroles.

Technology Process of 3-(1H-Pyrrol-1-yl)propanenitrile

There total 5 articles about 3-(1H-Pyrrol-1-yl)propanenitrile 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: 90.0%

: 109-97-7,30604-81-0
pyrrole

: 107-13-1,25014-41-9
acrylonitrile

: 43036-06-2
3-(pyrrol-1-yl)propanenitrile

Guidance literature:: With 1,8-diazabicyclo[5.4.0]undec-7-ene; at 20 ℃; for 20h; Inert atmosphere;
DOI:10.1021/ol1025348

Reference yield: 30.0%

: 31164-08-6
3-(diallylamino)propanenitrile

: 43036-06-2
3-(pyrrol-1-yl)propanenitrile

Guidance literature:: With tricyclohexylphosphine[1,3-bis(2,4,6-trimethylphenyl)-4,5-dihydroimidazol-2-ylidine][benzylidene]ruthenium(II) dichloride; ruthenium trichloride; In 1,2-dichloro-ethane; at 60 - 65 ℃; for 12h; sonification;
DOI:10.1016/j.tetlet.2004.10.044