4-(4-methyl-4H-1,2,4-triazol-3-yl)aniline

Base Information

Chemical Name:4-(4-methyl-4H-1,2,4-triazol-3-yl)aniline
CAS No.:690632-18-9
Molecular Formula:C9H10N4
Molecular Weight:174.205
Hs Code.:2933990090
European Community (EC) Number:687-632-6
DSSTox Substance ID:DTXSID90383410
Wikidata:Q82175104
Mol file:690632-18-9.mol

Synonyms:4-(4-methyl-4H-1,2,4-triazol-3-yl)aniline;690632-18-9;4-(4-methyl-1,2,4-triazol-3-yl)aniline;[4-(4-methyl-4H-1,2,4-triazol-3-yl)phenyl]amine;Benzenamine,4-(4-methyl-4H-1,2,4-triazol-3-yl)-;4-(4-methyl-1,2,4-triazol-3-yl)phenylamine;TimTec1_004161;SCHEMBL62239;Benzenamine, 4-(4-methyl-4H-1,2,4-triazol-3-yl)-;DTXSID90383410;HMS1545N03;MFCD06200885;STK803105;AKOS003375495;AT12464;AS-67404;CS-0247308;FT-0644847;EN300-36386;Z362840694;4-(4-methyl-4H-1,2,4-triazol-3-yl)aniline, AldrichCPR

Suppliers and Price of 4-(4-methyl-4H-1,2,4-triazol-3-yl)aniline

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-(4-methyl-4H-1,2,4-triazol-3-yl)aniline
100mg
$ 45.00

SynQuest Laboratories
4-(4-Methyl-4H-1,2,4-triazol-3-yl)aniline 90%
1 g
$ 480.00

Matrix Scientific
[4-(4-Methyl-4H-1,2,4-triazol-3-yl)phenyl]amine
5g
$ 1000.00

Matrix Scientific
[4-(4-Methyl-4H-1,2,4-triazol-3-yl)phenyl]amine
1g
$ 300.00

Matrix Scientific
[4-(4-Methyl-4H-1,2,4-triazol-3-yl)phenyl]amine
0.500g
$ 240.00

ChemBridge Corporation
4-(4-methyl-4H-1,2,4-triazol-3-yl)aniline 95%
200 μmol
$ 63.00

American Custom Chemicals Corporation
4-(4-METHYL-4H-1,2,4-TRIAZOL-3-YL)ANILINE 95.00%
5G
$ 1168.42

American Custom Chemicals Corporation
4-(4-METHYL-4H-1,2,4-TRIAZOL-3-YL)ANILINE 95.00%
2.5G
$ 983.88

American Custom Chemicals Corporation
4-(4-METHYL-4H-1,2,4-TRIAZOL-3-YL)ANILINE 95.00%
1G
$ 721.57

AK Scientific
4-(4-Methyl-4H-1,2,4-triazol-3-yl)aniline
2.5g
$ 604.00

Total 9 raw suppliers

Chemical Property of 4-(4-methyl-4H-1,2,4-triazol-3-yl)aniline

Chemical Property:

Vapor Pressure:2E-06mmHg at 25°C
Refractive Index:1.665
Boiling Point:394.3 °C at 760 mmHg
PKA:3.25±0.10(Predicted)
Flash Point:192.3 °C
PSA：56.73000
Density:1.27 g/cm³
LogP:1.64550
XLogP3:0.4
Hydrogen Bond Donor Count:1
Hydrogen Bond Acceptor Count:3
Rotatable Bond Count:1
Exact Mass:174.090546336
Heavy Atom Count:13
Complexity:165

Purity/Quality:

97% ^*data from raw suppliers

4-(4-methyl-4H-1,2,4-triazol-3-yl)aniline ^*data from reagent suppliers

Safty Information:

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

MSDS Files:: SDS file from LookChem

Useful:

Canonical SMILES:CN1C=NN=C1C2=CC=C(C=C2)N

Technology Process of 4-(4-methyl-4H-1,2,4-triazol-3-yl)aniline

There total 3 articles about 4-(4-methyl-4H-1,2,4-triazol-3-yl)aniline 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:

: 4-methyl-3-(4-nitrophenyl)-4H-1,2,4-triazole

: 690632-18-9
4-(4-methyl-4H-1,2,4-triazol-3-yl)aniline

Guidance literature:: With iron; ammonium chloride; In ethanol; water; at 90 ℃; for 1h;

Reference yield:

: 62-23-7
4-nitro-benzoic acid

: 690632-18-9
4-(4-methyl-4H-1,2,4-triazol-3-yl)aniline

Guidance literature:: Multi-step reaction with 3 steps

1.1: 1-ethyl-(3-(3-dimethylamino)propyl)-carbodiimide hydrochloride; benzotriazol-1-ol / N,N-dimethyl-formamide / 20 °C

1.2: 18 h / 60 °C

2.1: acetic acid; dihydrogen peroxide / dichloromethane / 3 h / 0 - 20 °C

3.1: ammonium chloride; iron / water; ethanol / 1 h / 90 °C

With dihydrogen peroxide; iron; ammonium chloride; benzotriazol-1-ol; acetic acid; 1-ethyl-(3-(3-dimethylamino)propyl)-carbodiimide hydrochloride; In ethanol; dichloromethane; water; N,N-dimethyl-formamide;

Reference yield:

: 57295-74-6
4-methyl-5-(4-nitrophenyl)-2,4-dihydro-[1,2,4]triazole-3-thione

: 690632-18-9
4-(4-methyl-4H-1,2,4-triazol-3-yl)aniline

Guidance literature:: Multi-step reaction with 2 steps

1: acetic acid; dihydrogen peroxide / dichloromethane / 3 h / 0 - 20 °C

2: ammonium chloride; iron / water; ethanol / 1 h / 90 °C

With dihydrogen peroxide; iron; ammonium chloride; acetic acid; In ethanol; dichloromethane; water;