4-Amino-3,5-dimethylphenyl thiocyanate

Base Information

Chemical Name:4-Amino-3,5-dimethylphenyl thiocyanate
CAS No.:14031-02-8
Molecular Formula:C9H10 N2 S
Molecular Weight:178.258
Hs Code.:2930909090
DSSTox Substance ID:DTXSID20367864
Nikkaji Number:J2.748.726B
Wikidata:Q82154003
Mol file:14031-02-8.mol

Synonyms:4-amino-3,5-dimethylphenyl thiocyanate;14031-02-8;(4-amino-3,5-dimethylphenyl) thiocyanate;2,6-Dimethyl-4-thiocyanatoaniline;[(4-amino-3,5-dimethylphenyl)sulfanyl]formonitrile;DTXSID20367864;MFCD00649562;AKOS008967126;3,5-Dimethyl-4-aminophenyl thiocyanate;NCGC00328048-01;CS-0220545;EN300-06908;AB01323218-02;Thiocyanic acid, 4-amino-3,5-dimethylphenyl ester;Z56938875

Suppliers and Price of 4-Amino-3,5-dimethylphenyl thiocyanate

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
[(4-amino-3,5-dimethylphenyl)sulfanyl]formonitrile
500mg
$ 310.00

American Custom Chemicals Corporation
4-AMINO-3,5-DIMETHYLPHENYL THIOCYANATE 95.00%
5G
$ 1082.56

American Custom Chemicals Corporation
4-AMINO-3,5-DIMETHYLPHENYL THIOCYANATE 95.00%
2.5G
$ 906.27

American Custom Chemicals Corporation
4-AMINO-3,5-DIMETHYLPHENYL THIOCYANATE 95.00%
1G
$ 677.91

AK Scientific
4-Amino-3,5-dimethylphenylthiocyanate
500mg
$ 289.00

Total 4 raw suppliers

Chemical Property of 4-Amino-3,5-dimethylphenyl thiocyanate

Chemical Property:

Vapor Pressure:0.000401mmHg at 25°C
Boiling Point:316.8°Cat760mmHg
Flash Point:145.4°C
PSA：75.11000
Density:1.19g/cm³
LogP:3.03998
XLogP3:2.5
Hydrogen Bond Donor Count:1
Hydrogen Bond Acceptor Count:3
Rotatable Bond Count:1
Exact Mass:178.05646950
Heavy Atom Count:12
Complexity:184

Purity/Quality:

99% ^*data from raw suppliers

[(4-amino-3,5-dimethylphenyl)sulfanyl]formonitrile ^*data from reagent suppliers

Safty Information:

Pictogram(s):
Hazard Codes:

MSDS Files:: SDS file from LookChem

Useful:

Canonical SMILES:CC1=CC(=CC(=C1N)C)SC#N

Technology Process of 4-Amino-3,5-dimethylphenyl thiocyanate

There total 5 articles about 4-Amino-3,5-dimethylphenyl thiocyanate 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: 96.0%

: ammonium thiocyanate

: 87-62-7
2,6-dimethylaniline

: 14031-02-8
2,6-dimethyl-4-thiocyanatobenzenamine

Guidance literature:: With trichloroisocyanuric acid; silica gel; In dichloromethane; at 20 ℃; for 0.05h; regioselective reaction;
DOI:10.1080/00397911.2010.537424

Reference yield: 94.0%

: 1147550-11-5
ammonium thiocyanate

: 87-62-7
2,6-dimethylaniline

: 14031-02-8
2,6-dimethyl-4-thiocyanatobenzenamine

Guidance literature:: With dimethylbromosulphonium bromide; In acetonitrile; at 20 ℃; for 0.25h;
DOI:10.1055/s-2007-992367

Reference yield: 89.0%

: 333-20-0
potassium thioacyanate

: 87-62-7
2,6-dimethylaniline

: 14031-02-8
2,6-dimethyl-4-thiocyanatobenzenamine

Guidance literature:: With N,N,N,N,-tetramethylethylenediamine; boron trifluoride diethyl etherate; oxygen; copper(II) bis(trifluoromethanesulfonate); In dimethyl sulfoxide; at 80 ℃; for 12h; regioselective reaction;
DOI:10.1021/acs.joc.7b01122