5-Methyl-3-phenylisoxazole-4-carboxaldehyde

Base Information

Chemical Name:5-Methyl-3-phenylisoxazole-4-carboxaldehyde
CAS No.:87967-95-1
Molecular Formula:C11H9 N O2
Molecular Weight:187.198
Hs Code.:2934999090
European Community (EC) Number:623-098-2
DSSTox Substance ID:DTXSID60379840
Nikkaji Number:J282.191E
Wikidata:Q82169844
Mol file:87967-95-1.mol

Synonyms:87967-95-1;5-Methyl-3-phenylisoxazole-4-carboxaldehyde;5-METHYL-3-PHENYL-4-ISOXAZOLECARBALDEHYDE;5-methyl-3-phenylisoxazole-4-carbaldehyde;5-methyl-3-phenyl-1,2-oxazole-4-carbaldehyde;5-methyl-3-phenyl-isoxazole-4-carbaldehyde;SCHEMBL195456;DTXSID60379840;SMSBKEHQYUYAHK-UHFFFAOYSA-N;MFCD02677714;AKOS022642404;PS-4240;BP-10378;3-phenyl-5-methyl-4-isoxazolecarbaldehyde;3-Phenyl-5-methylisoxazole-4-carbaldehyde;CS-0206616;FT-0620627;5-methyl-3-phenyl-4-isoxazole carboxaldehyde;4-Isoxazolecarboxaldehyde, 5-methyl-3-phenyl-;F17085;5-Methyl-3-phenylisoxazole-4-carboxaldehyde, 97%;J-517785

Suppliers and Price of 5-Methyl-3-phenylisoxazole-4-carboxaldehyde

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

Usbiological
5-Methyl-3-phenylisoxazole-4-carboxaldehyde
500mg
$ 333.00

TRC
5-Methyl-3-phenylisoxazole-4-carboxaldehyde
50mg
$ 45.00

SynQuest Laboratories
5-Methyl-3-phenylisoxazole-4-carboxaldehyde
250 mg
$ 23.00

SynQuest Laboratories
5-Methyl-3-phenylisoxazole-4-carboxaldehyde
1 g
$ 71.00

Sigma-Aldrich
5-Methyl-3-phenylisoxazole-4-carboxaldehyde 97%
1g
$ 79.10

Heterocyclics
5-Methyl-3-phenylisoxazole-4-carbaldehyde 97%
1g
$ 54.00

Heterocyclics
5-Methyl-3-phenylisoxazole-4-carbaldehyde 97%
5g
$ 238.00

Crysdot
5-Methyl-3-phenylisoxazole-4-carbaldehyde 95+%
1g
$ 83.00

Crysdot
5-Methyl-3-phenylisoxazole-4-carbaldehyde 95+%
10g
$ 698.00

Crysdot
5-Methyl-3-phenylisoxazole-4-carbaldehyde 95+%
5g
$ 371.00

Total 13 raw suppliers

Chemical Property of 5-Methyl-3-phenylisoxazole-4-carboxaldehyde

Chemical Property:

Vapor Pressure:2.26E-05mmHg at 25°C
Melting Point:41 °C
Boiling Point:110-112°C
Flash Point:110 °C
PSA：43.10000
Density:1.179g/cm³
LogP:2.46250
Storage Temp.:2-8°C
Sensitive.:Light Sensitive
XLogP3:1.9
Hydrogen Bond Donor Count:0
Hydrogen Bond Acceptor Count:3
Rotatable Bond Count:2
Exact Mass:187.063328530
Heavy Atom Count:14
Complexity:202

Purity/Quality:

97% ^*data from raw suppliers

5-Methyl-3-phenylisoxazole-4-carboxaldehyde ^*data from reagent suppliers

Safty Information:

Pictogram(s):
Hazard Codes:Xi,Xn
Statements: 22
Safety Statements: 24/25

MSDS Files:: SDS file from LookChem

Useful:

Canonical SMILES:CC1=C(C(=NO1)C2=CC=CC=C2)C=O

Technology Process of 5-Methyl-3-phenylisoxazole-4-carboxaldehyde

There total 9 articles about 5-Methyl-3-phenylisoxazole-4-carboxaldehyde 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%

: 18718-79-1
5-methyl-3-phenyl-4-isoxazolylmethanol

: 87967-95-1
5-methyl-3-phenylisoxazole-4-carboxaldehyde

Guidance literature:: With manganese(IV) oxide; In dichloromethane; at 20 ℃; Inert atmosphere;
DOI:10.1002/cmdc.201100522

Reference yield: 53.0%

: 873-67-6
benzonitrile oxide

: 123-73-9,4170-30-3
crotonaldehyde

: 87967-95-1
5-methyl-3-phenylisoxazole-4-carboxaldehyde

: (4S,5S)-4-Methyl-3-phenyl-4,5-dihydro-isoxazole-5-carbaldehyde

: (4S,5R)-5-Methyl-3-phenyl-4,5-dihydro-isoxazole-4-carbaldehyde

Guidance literature:: In diethyl ether; at 0 - 5 ℃; for 48h; Further Variations:; Reaction partners; Product distribution;
DOI:10.1016/S0040-4020(00)00356-2