4-Allyl-5-pyridin-4-yl-4H-[1,2,4]triazole-3-thiol

Base Information

Chemical Name:4-Allyl-5-pyridin-4-yl-4H-[1,2,4]triazole-3-thiol
CAS No.:90842-92-5
Molecular Formula:C10H10 N4 S
Molecular Weight:218.282
Hs Code.:2933990090
European Community (EC) Number:644-809-2
DSSTox Substance ID:DTXSID50353351
Nikkaji Number:J1.656.213K
Wikidata:Q82130889
ChEMBL ID:CHEMBL1338529
Mol file:90842-92-5.mol

Synonyms:90842-92-5;4-Allyl-5-pyridin-4-yl-4H-[1,2,4]triazole-3-thiol;4-allyl-5-pyridin-4-yl-4H-1,2,4-triazole-3-thiol;4-(prop-2-en-1-yl)-5-(pyridin-4-yl)-4H-1,2,4-triazole-3-thiol;4-prop-2-enyl-3-pyridin-4-yl-1H-1,2,4-triazole-5-thione;4-allyl-5-(pyridin-4-yl)-4h-1,2,4-triazole-3-thiol;CDS1_004622;CBMicro_030286;Oprea1_678454;Oprea1_830085;MLS000692746;DivK1c_005662;CHEMBL1338529;DTXSID50353351;HMS1666A17;HMS2644P12;BBL015215;MFCD01038799;STK397846;STK499051;AKOS000100117;AKOS000274000;4-(prop-2-en-1-yl)-3-(pyridin-4-yl)-4,5-dihydro-1H-1,2,4-triazole-5-thione;SMR000285116;VS-04856;BIM-0030223.P001;BB 0217205;CS-0220021;EU-0031877;EN300-05569;AB00095377-01;AF-615/30368031;4-allyl-3-(4-pyridyl)-1H-1,2,4-triazole-5-thione;Z56904737;4-allyl-5-(4-pyridinyl)-4H-1,2,4-triazole-3-thiol;F0464-0009;4-allyl-3-(pyridin-4-yl)-1H-1,2,4-triazole-5(4H)-thione;2,4-Dihydro-4-(2-propen-1-yl)-5-(4-pyridinyl)-3H-1,2,4-triazole-3-thione;3H-1,2,4-Triazole-3-thione, 2,4-dihydro-4-(2-propenyl)-5-(4-pyridinyl)-;4-(prop-2-en-1-yl)-5-(pyridin-4-yl)-2,4-dihydro-3H-1,2,4-triazole-3-thione

Suppliers and Price of 4-Allyl-5-pyridin-4-yl-4H-[1,2,4]triazole-3-thiol

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-(prop-2-en-1-yl)-5-(pyridin-4-yl)-4H-1,2,4-triazole-3-thiol
500mg
$ 240.00

TRC
4-(prop-2-en-1-yl)-5-(pyridin-4-yl)-4H-1,2,4-triazole-3-thiol
50mg
$ 45.00

Matrix Scientific
4-Allyl-5-pyridin-4-yl-4H-[1,2,4]triazole-3-thiol
500mg
$ 168.00

Crysdot
4-Allyl-5-(pyridin-4-yl)-4H-1,2,4-triazole-3-thiol 97%
5g
$ 532.00

Chemenu
4-allyl-5-pyridin-4-yl-4H-1,2,4-triazole-3-thiol 95%
10g
$ 336.00

Chemenu
4-allyl-5-pyridin-4-yl-4H-1,2,4-triazole-3-thiol 95%
5g
$ 228.00

Biosynth Carbosynth
4-Allyl-5-pyridin-4-yl-4H-1,2,4-triazole-3-thiol
2 g
$ 179.00

Biosynth Carbosynth
4-Allyl-5-pyridin-4-yl-4H-1,2,4-triazole-3-thiol
1 g
$ 105.00

Biosynth Carbosynth
4-Allyl-5-pyridin-4-yl-4H-1,2,4-triazole-3-thiol
500 mg
$ 60.00

Biosynth Carbosynth
4-Allyl-5-pyridin-4-yl-4H-1,2,4-triazole-3-thiol
10 g
$ 609.00

Total 5 raw suppliers

Chemical Property of 4-Allyl-5-pyridin-4-yl-4H-[1,2,4]triazole-3-thiol

Chemical Property:

Vapor Pressure:0.000241mmHg at 25°C
Refractive Index:1.677
Boiling Point:324.7°C at 760 mmHg
Flash Point:150.2°C
PSA：78.59000
Density:1.28g/cm³
LogP:2.18870
XLogP3:1.2
Hydrogen Bond Donor Count:1
Hydrogen Bond Acceptor Count:3
Rotatable Bond Count:3
Exact Mass:218.06261751
Heavy Atom Count:15
Complexity:294

Purity/Quality:

98%min ^*data from raw suppliers

4-(prop-2-en-1-yl)-5-(pyridin-4-yl)-4H-1,2,4-triazole-3-thiol ^*data from reagent suppliers

Safty Information:

Pictogram(s):
Hazard Codes:Xi

MSDS Files:: SDS file from LookChem

Useful:

Canonical SMILES:C=CCN1C(=NNC1=S)C2=CC=NC=C2

Technology Process of 4-Allyl-5-pyridin-4-yl-4H-[1,2,4]triazole-3-thiol

There total 7 articles about 4-Allyl-5-pyridin-4-yl-4H-[1,2,4]triazole-3-thiol 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: 80.0%

: 15886-23-4
4-allyl-1-(pyridine-4-yl-carbonyl)-thiosemicarbazide

: 90842-92-5
4-allyl-5-pyridin-4-yl-2,4-dihydro-3H-1,2,4-triazole-3-thione

Guidance literature:: With sodium hydroxide; for 8h; Reflux;
DOI:10.1016/j.saa.2012.01.027

Reference yield: 45.5%

: 109-57-9
Allylthiourea

: 54-85-3,7640-37-1
isoniazid

: 90842-92-5
4-allyl-5-pyridin-4-yl-2,4-dihydro-3H-1,2,4-triazole-3-thione

Guidance literature:: Allylthiourea; isoniazid; at 170 ℃;

With sodium hydroxide;
DOI:10.1134/S1070363219090299

Reference yield:

: 54-85-3,7640-37-1
isoniazid

: 57-06-7,58391-87-0
N-allyl isothiocyanate

: 90842-92-5
4-(prop-2-en-1-yl)-5-(pyridin-4-yl)-4H-1,2,4-triazole-3-thiol

Guidance literature:: isoniazid; N-allyl isothiocyanate; at 150 ℃; for 0.25h; Microwave irradiation;

With potassium carbonate; In water; for 16h; Reflux;
DOI:10.1016/j.bmcl.2014.04.081