4-Nitrophenyl isothiocyanate

Base Information Edit

Chemical Name:4-Nitrophenyl isothiocyanate
CAS No.:2131-61-5
Deprecated CAS:391256-09-0
Molecular Formula:C7H4 N2 O2 S
Molecular Weight:180.187
Hs Code.:29309090
European Community (EC) Number:218-359-9
NSC Number:84691
DSSTox Substance ID:DTXSID9062198
Nikkaji Number:J284.445A
Mol file:2131-61-5.mol

Synonyms:4-Nitrophenyl isothiocyanate;2131-61-5;1-Isothiocyanato-4-nitrobenzene;4-Nitrophenylisothiocyanate;p-Nitrophenyl isothiocyanate;Benzene, 1-isothiocyanato-4-nitro-;1-isothiocyanato-4-nitro-benzene;Isothiocyanic Acid 4-Nitrophenyl Ester;4-Nitrophenyl Isothiocyanate, 98% 25Gr;4-nitro-phenyl isothiocyanate;p-Nitrophenylthiocyanat;4nitrophenyl isothiocyanate;4-nitro-phenylisothiocyanate;(4-nitrophenyl)isothiocyanate;4-nitro-phenyl-isothiocyanate;Phenylisothiocyanate, 4-nitro;SCHEMBL206480;DTXSID9062198;SCHEMBL15630319;1-Isothiocyanato-4-nitrobenzene #;4-Nitrophenyl isothiocyanate, 98%;BCP20905;NSC84691;EINECS 218-359-9;MFCD00007307;NSC 84691;NSC-84691;STK301532;AKOS000120523;Isothiocyanic acid, p-nitrophenyl ester;AS-59386;BP-12887;FT-0618854;N0826;EN300-20963;A26607;W-206616;F1915-0003;1-ISOTHIOCYANATO-4-NITROBENZENE 4-NITROPHENYL ISOTHIOCYANATE P-NITROPHENYL ISOTHIOCYANATE 1-isothiocyanato-4-nitro-benzen

Suppliers and Price of 4-Nitrophenyl 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

Sigma-Aldrich
4-Nitrophenyl isothiocyanate 98%
25g
$ 168.00

SynQuest Laboratories
4-Nitrophenyl isothiocyanate 98%
5 g
$ 79.00

SynQuest Laboratories
4-Nitrophenyl isothiocyanate 98%
1 g
$ 40.00

SynQuest Laboratories
4-Nitrophenyl isothiocyanate 98%
25 g
$ 353.00

TCI Chemical
4-Nitrophenyl Isothiocyanate >99.0%(GC)
5g
$ 85.00

TCI Chemical
4-Nitrophenyl Isothiocyanate >99.0%(GC)
25g
$ 273.00

Usbiological
4-Nitrophenyl isothiocyanate
10g
$ 322.00

Sigma-Aldrich
4-Nitrophenyl isothiocyanate 98%
5g
$ 35.30

American Custom Chemicals Corporation
4-NITROPHENYL ISOTHIOCYANATE 95.00%
10G
$ 1152.75

American Custom Chemicals Corporation
4-NITROPHENYL ISOTHIOCYANATE 95.00%
5G
$ 826.84

Total 46 raw suppliers

Chemical Property of 4-Nitrophenyl isothiocyanate Edit

Chemical Property:

Appearance/Colour:gold powder.
Vapor Pressure:0mmHg at 25°C
Melting Point:110-112 °C(lit.)
Refractive Index:1.615
Boiling Point:331.1 °C at 760 mmHg
Flash Point:154.1 °C
PSA：90.27000
Density:1.33 g/cm³
LogP:2.85230
Storage Temp.:Store at
Sensitive.:Moisture Sensitive
Water Solubility.:It hydrolyzes with water. Soluble in toluene.
XLogP3:3.6
Hydrogen Bond Donor Count:0
Hydrogen Bond Acceptor Count:4
Rotatable Bond Count:1
Exact Mass:179.99934855
Heavy Atom Count:12
Complexity:212

Purity/Quality:

99% ^*data from raw suppliers

4-Nitrophenyl isothiocyanate 98% ^*data from reagent suppliers

Safty Information:

Pictogram(s): Xn
Hazard Codes:Xn
Statements: 36/37/38-42
Safety Statements: 22-26-36

MSDS Files:

SDS file from LookChem

Total 1 MSDS from other Authors

Useful:

Canonical SMILES:C1=CC(=CC=C1N=C=S)[N+](=O)[O-]
Uses 4-Nitrophenyl isothiocyanate is used as specializing in synthesizing of organic fine chemicals and pharmaceutical intermediates for use in development and production 4-Nitrophenyl isothiocyanate has been used in the synthesis of:5,6-dimethyl-2-[(4-nitrophenyl)amino]thieno[2,3-d]pyrimidin-4(3H)-one4,5-dimethyl-2-substituted carbamothioylaminothiophene-3-carboxamidesacyclic triazene or zwitterionic dihydropyrimidinium imidothiolate derivatives

Technology Process of 4-Nitrophenyl isothiocyanate

There total 37 articles about 4-Nitrophenyl 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: 99.0%