3-Chloropropionitrile

Base Information Edit

Chemical Name:3-Chloropropionitrile
CAS No.:542-76-7
Molecular Formula:C3H4 Cl N
Molecular Weight:89.5245
Hs Code.:29269095
European Community (EC) Number:208-827-0
NSC Number:2588
UN Number:3276,2810
UNII:61N7S4SZ2Q
DSSTox Substance ID:DTXSID4030336
Nikkaji Number:J35.375B
Wikipedia:3-Chloropropionitrile
Wikidata:Q4634123
ChEMBL ID:CHEMBL1451739
Mol file:542-76-7.mol

Synonyms:3-Chloropropionitrile;3-Chloropropanenitrile;542-76-7;3-Chloropropiononitrile;Propanenitrile, 3-chloro-;1-Chloro-2-cyanoethane;3-CHLOROPROPANONITRILE;Propionitrile, 3-chloro-;3-Chlorpropannitril;beta-Chloropropionitrile;USAF A-8798;RCRA waste number P027;.beta.-Chloropropionitrile;NSC 2588;3-Chlorpropannitril [Czech];HSDB 6042;Chloropropionitrile, 3-;EINECS 208-827-0;RCRA waste no. P027;BRN 1098454;UNII-61N7S4SZ2Q;AI3-28526;61N7S4SZ2Q;DTXSID4030336;NSC-2588;4-02-00-00751 (Beilstein Handbook Reference);DTXCID2010336;CAS-542-76-7;C3H4ClN;3-Chloropropanitrile;3-chloro-propionitrile;CH2ClCH2CN;Cl(CH2)2CN;WLN: NC2G;3-Chloropropionitrile, 98%;CHEMBL1451739;NSC2588;AMY21819;Tox21_202225;Tox21_303460;MFCD00001952;STL264202;3-CHLOROPROPANONITRILE [HSDB];AKOS001045367;LS-2151;.BETA.-CHLOROPROPIONITRILE [MI];NCGC00090983-01;NCGC00090983-02;NCGC00090983-03;NCGC00257316-01;NCGC00259774-01;EN300-17524;Q4634123;F8881-4925

Suppliers and Price of 3-Chloropropionitrile

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
3-Chloropropionitrile
100mg
$ 45.00

TRC
3-Chloropropionitrile
500mg
$ 65.00

TCI Chemical
3-Chloropropionitrile >98.0%(GC)
25mL
$ 31.00

TCI Chemical
3-Chloropropionitrile >98.0%(GC)
500mL
$ 214.00

Sigma-Aldrich
3-Chloropropionitrile 98%
500g
$ 333.00

Sigma-Aldrich
3-Chloropropionitrile 98%
100g
$ 75.30

Matrix Scientific
3-Chloropropanenitrile 95%+
1g
$ 101.00

Matrix Scientific
3-Chloropropanenitrile 95%+
2.500g
$ 215.00

Matrix Scientific
3-Chloropropanenitrile 95%+
5g
$ 323.00

Biosynth Carbosynth
3-Chloropropiononitrile
500 g
$ 280.00

Total 2 raw suppliers

Chemical Property of 3-Chloropropionitrile Edit

Chemical Property:

Vapor Pressure:1.08mmHg at 25°C
Melting Point:-51 ºC
Refractive Index:n20/D 1.438(lit.)
Boiling Point:174-174 ºC
Flash Point:168 ºF
Density:1.144
Storage Temp.:Store below +30°C.
Solubility.:45g/l
Water Solubility.:4.50 g/100 mL
XLogP3:0.2
Hydrogen Bond Donor Count:0
Hydrogen Bond Acceptor Count:1
Rotatable Bond Count:1
Exact Mass:89.0032268
Heavy Atom Count:5
Complexity:51.2
Transport DOT Label:Poison

Purity/Quality:: 3-Chloropropionitrile ^*data from reagent suppliers

Safty Information:

Pictogram(s):
Hazard Codes:T+
Statements: 23-28
Safety Statements: 36/37/39-45

MSDS Files:: SDS file from LookChem

Useful:

Chemical Classes:Nitrogen Compounds -> Nitriles
Canonical SMILES:C(CCl)C#N
Uses In pharmaceutical and polymer synthesis. Combines the reactivity of a nitrile and an alkyl halide. Because of the cyano group the chlorine atom is more reactive than in ordinary alkyl halides. 3-Chloropropionitrile is used in pharmaceutical and polymer synthesis.

Technology Process of 3-Chloropropionitrile

There total 21 articles about 3-Chloropropionitrile 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: 89.0%