5-(Methoxymethyl)isoxazole-4-carboxylic acid

Base Information

Chemical Name:5-(Methoxymethyl)isoxazole-4-carboxylic acid
CAS No.:134541-08-5
Molecular Formula:C6H7NO4
Molecular Weight:157.12
Hs Code.:
DSSTox Substance ID:DTXSID30564029
Nikkaji Number:J396.800F
Wikidata:Q82448596
Mol file:134541-08-5.mol

Synonyms:134541-08-5;5-(METHOXYMETHYL)ISOXAZOLE-4-CARBOXYLIC ACID;5-(Methoxymethyl)-1,2-oxazole-4-carboxylic acid;4-Isoxazolecarboxylicacid,5-(methoxymethyl)-(9CI);SCHEMBL262255;DTXSID30564029;VKYAVCXPZKRQAJ-UHFFFAOYSA-N;MFCD13193540;AKOS022175757;AM806357;AS-54811;CS-0047340;W10243;A906352;5-(METHOXYMETHYL)ISOXAZOLE-4-CARBOXYLICACID

Suppliers and Price of 5-(Methoxymethyl)isoxazole-4-carboxylic acid

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-(Methoxymethyl)Isoxazole-4-CarboxylicAcid
10mg
$ 45.00

Chemenu
5-(methoxymethyl)isoxazole-4-carboxylicacid 95%
1g
$ 701.00

Total 6 raw suppliers

Chemical Property of 5-(Methoxymethyl)isoxazole-4-carboxylic acid

Chemical Property:

Melting Point:69-70 °C
Boiling Point:300.5±27.0 °C(Predicted)
PKA:2.94±0.36(Predicted)
PSA：72.56000
Density:1.341±0.06 g/cm3(Predicted)
LogP:0.51920
XLogP3:-0.4
Hydrogen Bond Donor Count:1
Hydrogen Bond Acceptor Count:5
Rotatable Bond Count:3
Exact Mass:157.03750770
Heavy Atom Count:11
Complexity:150

Purity/Quality:

97% ^*data from raw suppliers

5-(Methoxymethyl)Isoxazole-4-CarboxylicAcid ^*data from reagent suppliers

Safty Information:

Pictogram(s):
Hazard Codes:

MSDS Files:: SDS file from LookChem

Useful:

Canonical SMILES:COCC1=C(C=NO1)C(=O)O

Technology Process of 5-(Methoxymethyl)isoxazole-4-carboxylic acid

There total 5 articles about 5-(Methoxymethyl)isoxazole-4-carboxylic 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: 85.0%

: 134540-99-1
methyl 5-(methoxymethyl)isoxazole-4-carboxylate

: 134541-08-5
5-(methoxymethyl)isoxazole-4-carboxylic acid

Guidance literature:: With hydrogenchloride; water; acetic acid; for 6h; Reflux;

Reference yield:

: 41051-15-4
4-methoxyacetoacetic acid methylester

: 134541-08-5
5-(methoxymethyl)isoxazole-4-carboxylic acid

Guidance literature:: Multi-step reaction with 3 steps

1: 20 h / 20 - 90 °C

2: hydroxylamine hydrochloride / methanol / 7 h / Reflux

3: hydrogenchloride; acetic acid; water / 6 h / Reflux

With hydrogenchloride; hydroxylamine hydrochloride; water; acetic acid; In methanol;

Reference yield:

: 127958-23-0
methyl 2-[(dimethylamino)methylene]-4-methoxy-3-oxobutanoate

: 134541-08-5
5-(methoxymethyl)isoxazole-4-carboxylic acid

Guidance literature:: Multi-step reaction with 2 steps

1: hydroxylamine hydrochloride / methanol / 7 h / Reflux

2: hydrogenchloride; acetic acid; water / 6 h / Reflux

With hydrogenchloride; hydroxylamine hydrochloride; water; acetic acid; In methanol;