4-phenyl-2,4-dihydro-3H-1,2,4-triazol-3-one

Base Information

Chemical Name:4-phenyl-2,4-dihydro-3H-1,2,4-triazol-3-one
CAS No.:1008-30-6
Molecular Formula:C8H7 N3 O
Molecular Weight:161.163
Hs Code.:2933990090
European Community (EC) Number:834-451-7
NSC Number:93434
DSSTox Substance ID:DTXSID50294013
Nikkaji Number:J2.356.441F
Wikidata:Q82033052
ChEMBL ID:CHEMBL1872813
Mol file:1008-30-6.mol

Synonyms:1008-30-6;4-phenyl-2,4-dihydro-3H-1,2,4-triazol-3-one;2,4-Dihydro-4-phenyl-3H-1,2,4-triazol-3-one;4-phenyl-1H-1,2,4-triazol-5-one;4-Phenyl-1H-1,2,4-triazol-5(4H)-one;4-phenyl-4,5-dihydro-1H-1,2,4-triazol-5-one;NSC93434;NCIOpen2_001519;MLS000736464;SCHEMBL3518937;CHEMBL1872813;DTXSID50294013;HMS2652F13;BAA00830;MFCD00266689;NSC 93434;NSC-93434;AKOS005070571;AKOS017269436;AT33263;SMR000338414;CS-0034583;FT-0680457;4-phenyl-2,4-dihydro[1,2,4]triazol-3-one;EN300-30636;5N-071;4-Phenyl-2,3-dihydro-4H-1,2,4-triazole-3-one;J-515931;Z57469886

Suppliers and Price of 4-phenyl-2,4-dihydro-3H-1,2,4-triazol-3-one

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-Phenyl-2,4-dihydro-3h-1,2,4-triazol-3-one
100mg
$ 65.00

SynQuest Laboratories
2,4-Dihydro-4-phenyl-3H-1,2,4-triazol-3-one
5 g
$ 696.00

SynQuest Laboratories
2,4-Dihydro-4-phenyl-3H-1,2,4-triazol-3-one
1 g
$ 244.00

SynQuest Laboratories
2,4-Dihydro-4-phenyl-3H-1,2,4-triazol-3-one
500 mg
$ 183.00

Matrix Scientific
4-Phenyl-2,4-dihydro-3H-1,2,4-triazol-3-one >95%
500mg
$ 171.00

Matrix Scientific
4-Phenyl-2,4-dihydro-3H-1,2,4-triazol-3-one >95%
1g
$ 228.00

Matrix Scientific
4-Phenyl-2,4-dihydro-3H-1,2,4-triazol-3-one >95%
5g
$ 524.00

Crysdot
4-Phenyl-1H-1,2,4-triazol-5(4H)-one 95+%
5g
$ 519.00

Atlantic Research Chemicals
4-Phenyl-2,4-dihydro-3H-1,2,4-triazol-3-one 95%
Price $/1gm:
$ 181.03

Apolloscientific
2,4-Dihydro-4-phenyl-3H-1,2,4-triazol-3-one
500mg
$ 154.00

Total 22 raw suppliers

Chemical Property of 4-phenyl-2,4-dihydro-3H-1,2,4-triazol-3-one

Chemical Property:

Melting Point:184-186°C
Boiling Point:°Cat760mmHg
PKA:9.48±0.20(Predicted)
Flash Point:°C
PSA：50.68000
Density:1.32g/cm³
LogP:0.56060
XLogP3:0.9
Hydrogen Bond Donor Count:1
Hydrogen Bond Acceptor Count:2
Rotatable Bond Count:1
Exact Mass:161.058911855
Heavy Atom Count:12
Complexity:208

Purity/Quality:

99%, ^*data from raw suppliers

4-Phenyl-2,4-dihydro-3h-1,2,4-triazol-3-one ^*data from reagent suppliers

Safty Information:

Pictogram(s):
Hazard Codes:Xi

MSDS Files:: SDS file from LookChem

Useful:

Canonical SMILES:C1=CC=C(C=C1)N2C=NNC2=O

Technology Process of 4-phenyl-2,4-dihydro-3H-1,2,4-triazol-3-one

There total 28 articles about 4-phenyl-2,4-dihydro-3H-1,2,4-triazol-3-one 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: 94.0%

: 912482-18-9
(E)-N'-(ethoxymethylene)hydrazinecarboxylic acid methyl ester

: 62-53-3
aniline

: 1008-30-6
4-phenyl-2,4-dihydro-[1,2,4]triazol-3-one

Guidance literature:: (E)-N'-(ethoxymethylene)hydrazinecarboxylic acid methyl ester; aniline; In ethanol; at 50 ℃;

With sodium methylate; In methanol; ethanol; at 75 ℃;
DOI:10.1016/j.tetlet.2006.07.089

Reference yield: 92.0%

: 1246923-44-3
C₁₅H₁₃N₃O

: 1008-30-6
4-phenyl-2,4-dihydro-[1,2,4]triazol-3-one

Guidance literature:: With trifluorormethanesulfonic acid; In toluene; at 150 ℃; for 0.25h; Microwave irradiation;
DOI:10.1016/j.tetlet.2010.07.022