4-Bromobutyronitrile

Base Information Edit

Chemical Name:4-Bromobutyronitrile
CAS No.:5332-06-9
Molecular Formula:C4H6 Br N
Molecular Weight:148.002
Hs Code.:2926909090
European Community (EC) Number:226-236-6
NSC Number:3972
UNII:ZL4S2TPT2V
DSSTox Substance ID:DTXSID5063786
Nikkaji Number:J42.923F
Wikidata:Q72452151
Mol file:5332-06-9.mol

Synonyms:4-Bromobutyronitrile;4-Bromobutanenitrile;5332-06-9;Butanenitrile, 4-bromo-;1253-67-4;3-Bromopropyl cyanide;3-Cyanopropyl bromide;BUTYRONITRILE, 4-BROMO-;gamma-Bromobutyronitrile;1-Bromo-3-cyanopropane;USAF DO-6;4-bromo-butyronitrile;NSC 3972;MFCD00001971;.gamma.-Bromobutyronitrile;ZL4S2TPT2V;NSC-3972;EINECS 226-236-6;BRN 0956577;AI3-52296;C4H6BrN;Trimethylene Bromocyanide;NSC3972;4-Bromobutannitrile;4-bromobutanonitrile;UNII-ZL4S2TPT2V;WLN: NC3E;4-Bromobutyronitrile, 97%;SCHEMBL129963;DTXSID5063786;AMY10438;AKOS009157109;CS-W004123;CS-17314;LS-48218;SY012834;B0565;FT-0617881;FT-0650721;EN300-107148;4-02-00-00836 (Beilstein Handbook Reference);Benzenepropanoic acid, 4-(methylthio)-.alpha.-oxo-;J-802131;Q-200448;F0001-1378

Suppliers and Price of 4-Bromobutyronitrile

Supply Marketing:Edit

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
4-Bromobutyronitrile
25g
$ 130.00

TCI Chemical
4-Bromobutyronitrile >97.0%(GC)
5g
$ 20.00

TCI Chemical
4-Bromobutyronitrile >97.0%(GC)
25g
$ 49.00

Sigma-Aldrich
4-Bromobutyronitrile 97%
25g
$ 102.00

Sigma-Aldrich
4-Bromobutyronitrile 97%
5g
$ 35.00

Oakwood
4-Bromobutyronitrile
25g
$ 36.00

Oakwood
4-Bromobutyronitrile
5g
$ 18.00

Oakwood
4-Bromobutyronitrile
1g
$ 10.00

Oakwood
4-Bromobutyronitrile
100g
$ 135.00

Matrix Scientific
4-Bromobutanenitrile 95%
100g
$ 105.00

Total 68 raw suppliers

Chemical Property of 4-Bromobutyronitrile Edit

Chemical Property:

Appearance/Colour:Colorless to yellow liquid
Vapor Pressure:0.23mmHg at 25°C
Melting Point:104-105 °C
Refractive Index:n20/D 1.478(lit.)
Boiling Point:207°Cat760mmHg
Flash Point:103.9°C
PSA：23.79000
Density:1.463g/cm³
LogP:1.68508
Storage Temp.:2-8°C
Water Solubility.:Miscible with toluene and benzene. Immiscible with water.
XLogP3:1
Hydrogen Bond Donor Count:0
Hydrogen Bond Acceptor Count:1
Rotatable Bond Count:2
Exact Mass:146.96836
Heavy Atom Count:6
Complexity:61.2

Purity/Quality:

98%,99%, ^*data from raw suppliers

4-Bromobutyronitrile ^*data from reagent suppliers

Safty Information:

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

MSDS Files:: SDS file from LookChem

Useful:

Canonical SMILES:C(CC#N)CBr
Uses 4-bromobutyronitrile is used as a precursor for the preparation of cylopropyl cyanide. Its derivative, 4-Bromo-2,2-Diphenyl Butyronitrile is used as an intermediate for loperamide.

Technology Process of 4-Bromobutyronitrile

There total 17 articles about 4-Bromobutyronitrile 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: 76.0%