3-(Trifluoromethyl)isoxazol-5-amine

Base Information

Chemical Name:3-(Trifluoromethyl)isoxazol-5-amine
CAS No.:108655-63-6
Molecular Formula:C4H3 F3 N2 O
Molecular Weight:152.076
Hs Code.:2934999090
European Community (EC) Number:840-090-6
DSSTox Substance ID:DTXSID20552415
Wikidata:Q82432644
Mol file:108655-63-6.mol

Synonyms:108655-63-6;3-(Trifluoromethyl)isoxazol-5-amine;3-(trifluoromethyl)-1,2-oxazol-5-amine;3-(trifluoromethyl)-5-isoxazolamine;3-Trifluoromethyl-5-aminoisoxazole;3-Trifluoromethyl-isoxazol-5-ylamine;C4H3F3N2O;5-Amino-3-(trifluoromethyl)isoxazol;MFCD04972407;5-Amino-3-(trifluoromethyl)isoxazole;5-Isoxazolamine, 3-(trifluoromethyl)-;SCHEMBL573342;DTXSID20552415;PAYOWUGPXPPRPB-UHFFFAOYSA-N;YNJAVYDUZJPHIU-UHFFFAOYSA-N;5-amino-3-trifluoromethylisoxazole;AKOS005072762;CS-W006573;FD-0252;SB30594;SY031911;EN300-50317;A895206;J-511028;Z381268116

Suppliers and Price of 3-(Trifluoromethyl)isoxazol-5-amine

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
3-(Trifluoromethyl)isoxazol-5-amine
100mg
$ 65.00

SynQuest Laboratories
5-Amino-3-(trifluoromethyl)isoxazole
1 g
$ 344.00

SynQuest Laboratories
5-Amino-3-(trifluoromethyl)isoxazole
500 mg
$ 264.00

Matrix Scientific
3-(Trifluoromethyl)-5-isoxazolamine >95%
500mg
$ 98.00

Matrix Scientific
3-(Trifluoromethyl)-5-isoxazolamine >95%
1g
$ 150.00

J&W Pharmlab
3-Trifluoromethyl-isoxazol-5-ylamine 96%
25g
$ 1592.00

J&W Pharmlab
3-Trifluoromethyl-isoxazol-5-ylamine 96%
500mg
$ 118.00

Crysdot
3-(Trifluoromethyl)isoxazol-5-amine 95+%
250mg
$ 59.00

Crysdot
3-(Trifluoromethyl)isoxazol-5-amine 95+%
1g
$ 149.00

Crysdot
3-(Trifluoromethyl)isoxazol-5-amine 95+%
5g
$ 446.00

Total 32 raw suppliers

Chemical Property of 3-(Trifluoromethyl)isoxazol-5-amine

Chemical Property:

Vapor Pressure:0.143mmHg at 25°C
Melting Point:53-55°
Refractive Index:1.424
Boiling Point:216.072°C at 760 mmHg
PKA:-2.65±0.10(Predicted)
Flash Point:84.478°C
PSA：52.05000
Density:1.502g/cm³
LogP:1.85680
Storage Temp.:under inert gas (nitrogen or Argon) at 2–8 °C
XLogP3:0.9
Hydrogen Bond Donor Count:1
Hydrogen Bond Acceptor Count:6
Rotatable Bond Count:0
Exact Mass:152.01974721
Heavy Atom Count:10
Complexity:126

Purity/Quality:

97% ^*data from raw suppliers

3-(Trifluoromethyl)isoxazol-5-amine ^*data from reagent suppliers

Safty Information:

Pictogram(s):
Hazard Codes:

MSDS Files:: SDS file from LookChem

Useful:

Canonical SMILES:C1=C(ON=C1C(F)(F)F)N

Technology Process of 3-(Trifluoromethyl)isoxazol-5-amine

There total 5 articles about 3-(Trifluoromethyl)isoxazol-5-amine 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: 41.0%

: 108655-62-5
5-Amino-3-trifluoromethylisoxazole-4-carboxamide

: 108655-63-6
3-(trifluoromethyl)isoxazole-5-amine

Guidance literature:: With hydrogenchloride; In acetic acid; for 3h; Heating;

Reference yield: 37.0%

: 151-50-8
potassium cyanide

: 117341-57-8
3-bromo-1,1,1-trifluoropropan-2-one oxime

: 108655-63-6
3-(trifluoromethyl)isoxazole-5-amine

Guidance literature:: In methanol; at 20 ℃; for 3h;

Reference yield: 11.0%

: 110234-78-1
4,4,4-trifluoro-3-methoxybut-2-enenitrile

: 108655-63-6
3-(trifluoromethyl)isoxazole-5-amine

Guidance literature:: 4,4,4-trifluoro-3-methoxybut-2-enenitrile; With hydroxylamine hydrochloride; sodium methylate; In methanol; at 0 - 60 ℃; for 15h;

With hydrogenchloride; In ethanol; water; at 60 ℃; for 2h;
DOI:10.1021/jm2009925