5-Thiophen-2-yl-isoxazole-3-carbaldehyde

Base Information

Chemical Name:5-Thiophen-2-yl-isoxazole-3-carbaldehyde
CAS No.:465514-11-8
Molecular Formula:C₈H₅NO₂S
Molecular Weight:179.199
Hs Code.:2934999090
European Community (EC) Number:692-233-5
DSSTox Substance ID:DTXSID20380174
Wikidata:Q82170278
Mol file:465514-11-8.mol

Synonyms:465514-11-8;5-Thiophen-2-yl-isoxazole-3-carbaldehyde;5-(2-Thienyl)-3-isoxazolecarbaldehyde;5-(thiophen-2-yl)isoxazole-3-carbaldehyde;5-thiophen-2-yl-1,2-oxazole-3-carbaldehyde;5-(thiophen-2-yl)-1,2-oxazole-3-carbaldehyde;3-Formyl-5-(thien-2-yl)isoxazole;5-(2-thienyl)isoxazole-3-carbaldehyde;3-Isoxazolecarboxaldehyde,5-(2-thienyl)-;SCHEMBL620758;DTXSID20380174;ICENILRKNUKRPB-UHFFFAOYSA-N;MFCD03086160;AKOS006229049;AS-5583;5-(Thien-2-yl)isoxazole-3-carboxaldehyde;CS-0314770;FT-0619608;A872252;5-(2-thienyl)-3-isoxazolecarbaldehyde, AldrichCPR;J-516416;5-(Thiophen-2-yl)isoxazole-3-carboxaldehyde, AldrichCPR

Suppliers and Price of 5-Thiophen-2-yl-isoxazole-3-carbaldehyde

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
5-Thiophen-2-yl-isoxazole-3-carbaldehyde
10mg
$ 45.00

SynQuest Laboratories
5-(Thien-2-yl)isoxazole-3-carboxaldehyde 90%
1 g
$ 712.00

SynQuest Laboratories
5-(Thien-2-yl)isoxazole-3-carboxaldehyde 90%
100 mg
$ 224.00

SynQuest Laboratories
5-(Thien-2-yl)isoxazole-3-carboxaldehyde 90%
250 mg
$ 392.00

Sigma-Aldrich
5-(Thiophen-2-yl)isoxazole-3-carboxaldehyde Aldrich
1g
$ 277.00

Matrix Scientific
5-Thiophen-2-yl-isoxazole-3-carbaldehyde 95+%
1g
$ 511.00

Heterocyclics
5-(Thiophen-2-yl)isoxazole-3-carboxaldehyde
1g
$ 181.00

Heterocyclics
5-(Thiophen-2-yl)isoxazole-3-carboxaldehyde
250mg
$ 92.00

Heterocyclics
5-(Thiophen-2-yl)isoxazole-3-carboxaldehyde
5g
$ 588.00

Crysdot
5-(Thiophen-2-yl)isoxazole-3-carbaldehyde 95+%
5g
$ 971.00

Total 13 raw suppliers

Chemical Property of 5-Thiophen-2-yl-isoxazole-3-carbaldehyde

Chemical Property:

Vapor Pressure:1.55E-05mmHg at 25°C
Melting Point:66oC
Boiling Point:365.6oC at 760 mmHg
Flash Point:174.9oC
PSA：71.34000
Density:1.358g/cm3
LogP:2.21560
XLogP3:1.5
Hydrogen Bond Donor Count:0
Hydrogen Bond Acceptor Count:4
Rotatable Bond Count:2
Exact Mass:179.00409958
Heavy Atom Count:12
Complexity:176

Purity/Quality:

97% ^*data from raw suppliers

5-Thiophen-2-yl-isoxazole-3-carbaldehyde ^*data from reagent suppliers

Safty Information:

Pictogram(s):
Hazard Codes:Xn
Statements: 36/37/38-22
Safety Statements: 26-36/37/39

MSDS Files:: SDS file from LookChem

Useful:

Canonical SMILES:C1=CSC(=C1)C2=CC(=NO2)C=O

Technology Process of 5-Thiophen-2-yl-isoxazole-3-carbaldehyde

There total 5 articles about 5-Thiophen-2-yl-isoxazole-3-carbaldehyde 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: 78.0%

: 194491-44-6
[5-(2-thienyl)isoxazol-3-yl]methanol

: 465514-11-8
5-(2-thienyl)isoxazole-3-carbaldehyde

Guidance literature:: With pyridinium chlorochromate; In dichloromethane; at 20 ℃;
DOI:10.1002/chem.201102571

Reference yield:

: 88-15-3,97511-16-5
2-Acetylthiophene

: 465514-11-8
5-(2-thienyl)isoxazole-3-carbaldehyde

Guidance literature:: Multi-step reaction with 4 steps

1: potassium tert-butylate / toluene / 0 - 20 °C

2: hydroxylamine hydrochloride / ethanol / 3 h / Reflux

3: sodium tetrahydroborate / ethanol / 0 - 20 °C

4: pyridinium chlorochromate / dichloromethane / 20 °C

With sodium tetrahydroborate; hydroxylamine hydrochloride; potassium tert-butylate; pyridinium chlorochromate; In ethanol; dichloromethane; toluene;
DOI:10.1002/chem.201102571

Reference yield:

: 5370-25-2
2-Acetyl-5-bromothiophene

: 465514-11-8
5-(2-thienyl)isoxazole-3-carbaldehyde

Guidance literature:: Multi-step reaction with 5 steps

1: toluene-4-sulfonic acid / ethylene glycol; toluene / Reflux

2: potassium tert-butylate / toluene / 0 - 20 °C

3: hydroxylamine hydrochloride / ethanol / 3 h / Reflux

4: sodium tetrahydroborate / ethanol / 0 - 20 °C

5: pyridinium chlorochromate / dichloromethane / 20 °C

With sodium tetrahydroborate; hydroxylamine hydrochloride; potassium tert-butylate; toluene-4-sulfonic acid; pyridinium chlorochromate; In ethanol; dichloromethane; ethylene glycol; toluene;
DOI:10.1002/chem.201102571