(3-(4-(Trifluoromethyl)phenyl)isoxazol-5-yl)methanol

Base Information

Chemical Name:(3-(4-(Trifluoromethyl)phenyl)isoxazol-5-yl)methanol
CAS No.:206055-88-1
Molecular Formula:C₁₁H₈F₃NO₂
Molecular Weight:243.185
Hs Code.:
DSSTox Substance ID:DTXSID801231236
ChEMBL ID:CHEMBL140918

Synonyms:(3-(4-(trifluoromethyl)phenyl)isoxazol-5-yl)methanol;206055-88-1;CHEMBL140918;SCHEMBL2120020;DTXSID801231236;MFCD19093997;AKOS013482592;3-[4-(Trifluoromethyl)phenyl]-5-isoxazolemethanol;[3-(4-Trifluoromethyl-phenyl)-isoxazol-5-yl]-methanol;{3-[4-(trifluoromethyl)phenyl]-1,2-oxazol-5-yl}methanol

Suppliers and Price of (3-(4-(Trifluoromethyl)phenyl)isoxazol-5-yl)methanol

Supply Marketing:

Business phase:: The product has achieved commercial mass production^*data from LookChem market partment

Manufacturers and distributors:

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Total 1 raw suppliers

Chemical Property of (3-(4-(Trifluoromethyl)phenyl)isoxazol-5-yl)methanol

Chemical Property:

XLogP3:2.1
Hydrogen Bond Donor Count:1
Hydrogen Bond Acceptor Count:6
Rotatable Bond Count:2
Exact Mass:243.05071298
Heavy Atom Count:17
Complexity:252

Purity/Quality:

Safty Information:

Pictogram(s):
Hazard Codes:

MSDS Files:: SDS file from LookChem

Useful:

Canonical SMILES:C1=CC(=CC=C1C2=NOC(=C2)CO)C(F)(F)F

Technology Process of (3-(4-(Trifluoromethyl)phenyl)isoxazol-5-yl)methanol

There total 4 articles about (3-(4-(Trifluoromethyl)phenyl)isoxazol-5-yl)methanol 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: 71.0%

: 74467-05-3
N-hydroxy-4-(trifluoromethyl)benzenecarboximidoyl chloride

: 107-19-7
propargyl alcohol

: 206055-88-1
3-(4-trifluoromethylphenyl)-5-hydroxymethylisoxazole

Guidance literature:: With potassium hydrogencarbonate; copper(II) sulfate; sodium L-ascorbate; In water; tert-butyl alcohol; at 20 ℃; for 1.5h;
DOI:10.1002/jccs.200700092

Reference yield:

: 107-19-7
propargyl alcohol

: (Z)-N-hydroxy-4-(trifluoromethyl)benzimidoyl chloride

: 206055-88-1
3-(4-trifluoromethylphenyl)-5-hydroxymethylisoxazole

Guidance literature:: With triethylamine; In dichloromethane; at 0 - 20 ℃; Yield given;
DOI:10.1021/jm9803121

Reference yield:

: 66046-34-2
4-(trifluoromethyl)benzaldehyde oxime

: 206055-88-1
3-(4-trifluoromethylphenyl)-5-hydroxymethylisoxazole

Guidance literature:: Multi-step reaction with 2 steps

1: N-chlorosuccinimide / dimethylformamide / Ambient temperature

2: Et₃N / CH₂Cl₂ / 0 - 20 °C

With N-chloro-succinimide; triethylamine; In dichloromethane; N,N-dimethyl-formamide;
DOI:10.1021/jm9803121