2-Chloroallyl isothiocyanate

Base Information Edit

Chemical Name:2-Chloroallyl isothiocyanate
CAS No.:14214-31-4
Molecular Formula:C4H4 Cl N S
Molecular Weight:133.601
Hs Code.:2930909090
European Community (EC) Number:604-275-3
DSSTox Substance ID:DTXSID30161951
Nikkaji Number:J41.138H
Mol file:14214-31-4.mol

Synonyms:14214-31-4;2-Chloro-3-isothiocyanatopropene;2-Chloroallyl isothiocyanate;2-chloro-3-isothiocyanatoprop-1-ene;1-Propene,2-chloro-3-isothiocyanato-;C4H4ClNS;1-Propene, 2-chloro-3-isothiocyanato-;beta-Chloroallyl isothiocyanate;ISOTHIOCYANIC ACID, 2-CHLOROALLYL ESTER;2-Chloro-3-isothiocyanato-1-propene;2-chloro-3-isothiocyanato-prop-1-ene;BRN 1748580;2-Chlor-3-isothiocyanato-1-propene;EC 604-275-3;2-chloro-allyl isothiocyanate;SCHEMBL1040201;NIOSH/NX8456000;DTXSID30161951;MFCD01716868;AKOS006229353;AS-75974;LS-86397;LS-86399;FT-0685671;NX84560000;F87663;J-508662;(Z)-2-Chloroallylisothiocyanate and (E)-2-chloroallylisothiocyanate;Isothiocyanic acid, 2-chloroallyl ester (Z)- and (E)-2-chloroallylisothiocyanate

Suppliers and Price of 2-Chloroallyl isothiocyanate

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
2-Chloro-3-isothiocyanatopropene
500mg
$ 110.00

TRC
2-Chloro-3-isothiocyanatopropene
100mg
$ 60.00

Synthonix
2-Chloro-3-isothiocyanatopropene 95%
1g
$ 45.00

Synthonix
2-Chloro-3-isothiocyanatopropene 95%
5g
$ 195.00

Synthonix
2-Chloro-3-isothiocyanatopropene 95%
25g
$ 595.00

SynQuest Laboratories
2-Chloro-3-isothiocyanatopropene 95%
5 g
$ 712.00

SynQuest Laboratories
2-Chloro-3-isothiocyanatopropene 95%
1 g
$ 200.00

Sigma-Aldrich
2-Chloro-3-isothiocyanatopropene
1g
$ 83.50

Matrix Scientific
2-Chloro-3-isothiocyanatopropene 97%
25g
$ 1143.00

Matrix Scientific
2-Chloro-3-isothiocyanatopropene 97%
5g
$ 393.00

Total 15 raw suppliers

Chemical Property of 2-Chloroallyl isothiocyanate Edit

Chemical Property:

Vapor Pressure:1.13mmHg at 25°C
Refractive Index:1.5560 (estimate)
Boiling Point:182oC at 760 mmHg
Flash Point:63.9oC
PSA：44.45000
Density:1.12g/cm3
LogP:1.84170
XLogP3:2.8
Hydrogen Bond Donor Count:0
Hydrogen Bond Acceptor Count:2
Rotatable Bond Count:2
Exact Mass:132.9752980
Heavy Atom Count:7
Complexity:115

Purity/Quality:

99.9% ^*data from raw suppliers

2-Chloro-3-isothiocyanatopropene ^*data from reagent suppliers

Safty Information:

Pictogram(s):
Hazard Codes:T
Statements: 25
Safety Statements: 45

MSDS Files:: SDS file from LookChem

Useful:

Canonical SMILES:C=C(CN=C=S)Cl

Technology Process of 2-Chloroallyl isothiocyanate

There total 8 articles about 2-Chloroallyl isothiocyanate 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: 99.8%