2-(3-Methylisoxazol-5-yl)acetic acid

Base Information Edit

Chemical Name:2-(3-Methylisoxazol-5-yl)acetic acid
CAS No.:19668-85-0
Molecular Formula:C6H7 N O3
Molecular Weight:141.126
Hs Code.:29349990
European Community (EC) Number:628-134-0
DSSTox Substance ID:DTXSID20400669
ChEMBL ID:CHEMBL3108872
Mol file:19668-85-0.mol

Synonyms:19668-85-0;2-(3-methylisoxazol-5-yl)acetic acid;3-Methyl-5-isoxazoleacetic acid;2-(3-methyl-1,2-oxazol-5-yl)acetic acid;5-Isoxazoleacetic acid, 3-methyl-;3-Methylisoxazole-5-acetic Acid;MFCD01863539;2-(3-methyl-isoxazol-5-yl)-acetic acid;3-METHYL-5-ISOXAZOLEACETIC ACID 98;5-Isoxazoleacetic acid,3-methyl-;(3-methyl-1,2-oxazol-5-yl)acetic acid;UPCMLD00X19668-85-0:001;SCHEMBL6251;3-Methylisoxazole-5-aceticAcid;CHEMBL3108872;DTXSID20400669;3-methyl-5-isoxazole acetic acid;POEFJFLAFQWOTL-UHFFFAOYSA-N;(3-Methylisoxazol-5-yl)acetic acid;3-Methyl-isoxazol-5-yl-acetic acid;(3-methyl-isoxazol-5-yl)acetic acid;AKOS006223498;(3-methyl-isoxazol-5-yl)-acetic acid;PB41664;2-(3-methyl-isoxazol-5-yl)acetic acid;2-(3-methylisoxazol-5-yl) acetic acid;2-(3-methylisoxazol-5-yl)-acetic acid;3-Methyl-5-isoxazoleacetic acid, 98%;SY128203;TS-01836;CS-0067394;FT-0747650;EN300-210289;J-012716;F9994-0446;Z1205493696

Suppliers and Price of 2-(3-Methylisoxazol-5-yl)acetic acid

Supply Marketing:Edit

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-Methyl-5-isoxazoleacetic acid
500mg
$ 90.00

SynQuest Laboratories
(3-Methylisoxazol-5-yl)acetic acid
5 g
$ 253.00

SynQuest Laboratories
(3-Methylisoxazol-5-yl)acetic acid
1 g
$ 90.00

Sigma-Aldrich
3-Methyl-5-isoxazoleacetic acid 98%
1g
$ 35.60

Sigma-Aldrich
3-Methyl-5-isoxazoleacetic acid 98%
5g
$ 124.00

Matrix Scientific
3-Methyl-5-isoxazoleacetic acid 97%
10g
$ 756.00

Matrix Scientific
3-Methyl-5-isoxazoleacetic acid 97%
1g
$ 120.00

Crysdot
2-(3-Methylisoxazol-5-yl)aceticacid 95+%
25g
$ 405.00

ChemScene
2-(3-Methylisoxazol-5-yl)aceticacid 99.57%
5g
$ 120.00

ChemScene
2-(3-Methylisoxazol-5-yl)aceticacid 99.57%
10g
$ 235.00

Total 23 raw suppliers

Chemical Property of 2-(3-Methylisoxazol-5-yl)acetic acid Edit

Chemical Property:

Vapor Pressure:0.000331mmHg at 25°C
Melting Point:101-104 °C(lit.)
Refractive Index:1.508
Boiling Point:306.7°C at 760 mmHg
PKA:3.70±0.10(Predicted)
Flash Point:139.3°C
PSA：63.33000
Density:1.292g/cm³
LogP:0.61010
Storage Temp.:2-8°C
XLogP3:0.3
Hydrogen Bond Donor Count:1
Hydrogen Bond Acceptor Count:4
Rotatable Bond Count:2
Exact Mass:141.042593085
Heavy Atom Count:10
Complexity:137

Purity/Quality:

98%,99%, ^*data from raw suppliers

3-Methyl-5-isoxazoleacetic acid ^*data from reagent suppliers

Safty Information:

Pictogram(s):
Hazard Codes:Xi
Statements: 36/37/38
Safety Statements: 26-36

MSDS Files:: SDS file from LookChem

Useful:

Canonical SMILES:CC1=NOC(=C1)CC(=O)O
Uses 3-Methyl-5-isoxazoleacetic acid may be used as a reagent in the solid phase synthesis of von Hippel-Lindau protein (VHL) ligands. It may also be used to prepare (N-(4-chlorophenyl)-α-[[(4-chlorophenyl)amino]methylene]-3-methyl-5-isoxazoleacetamide).

Technology Process of 2-(3-Methylisoxazol-5-yl)acetic acid

There total 3 articles about 2-(3-Methylisoxazol-5-yl)acetic acid 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: 89.0%

: 300-87-8
3,5-dimethyl-1,2-oxazole

: 124-38-9,18923-20-1
carbon dioxide

: 19668-85-0
2-(3-methylisoxazol-5-yl)acetic acid

Guidance literature:: 3,5-dimethyl-1,2-oxazole; With n-butyllithium; In tetrahydrofuran; hexane; at -78 ℃; for 1h; Inert atmosphere;

carbon dioxide; In tetrahydrofuran; hexane; at 20 ℃; for 1h; under 760.051 Torr;