5-(Thiophen-2-yl)isoxazole-3-carboxylic acid

Base Information

• Chemical Name: 5-(Thiophen-2-yl)isoxazole-3-carboxylic acid
• CAS No.: 763109-71-3
• Molecular Formula: C8H5 N O3 S
• Molecular Weight: 195.2
• Hs Code.: 2934999090
• European Community (EC) Number: 692-360-6
• DSSTox Substance ID: DTXSID80390097
• Wikidata: Q82186515
• ChEMBL ID: CHEMBL4207819
• Mol file: 763109-71-3.mol

Synonyms:763109-71-3;5-(thiophen-2-yl)isoxazole-3-carboxylic acid;5-Thiophen-2-yl-isoxazole-3-carboxylic acid;5-(2-thienyl)isoxazole-3-carboxylic acid;5-thiophen-2-yl-1,2-oxazole-3-carboxylic acid;5-thien-2-ylisoxazole-3-carboxylic acid;5-(thiophen-2-yl)-1,2-oxazole-3-carboxylic acid;3-Isoxazolecarboxylicacid, 5-(2-thienyl)-;MFCD04113955;5-(2-thienyl)-3-isoxazolecarboxylic acid;BAS 07803753;5-THIOPHEN-2-YL-ISOXAZOLE-3-CARBOXYLICACID;SCHEMBL619636;CHEMBL4207819;DTXSID80390097;OBTRHBQUXRJHJR-UHFFFAOYSA-N;BBL039965;STK349639;AKOS000263558;AS-5242;SY015177;BB 0259522;CS-0071106;FT-0677310;EN300-24764;A865507;F3284-8087

Chemical Property of 5-(Thiophen-2-yl)isoxazole-3-carboxylic acid

Chemical Property:

• Vapor Pressure: 1.22E-08mmHg at 25°C
• Melting Point: 168 °C
• Refractive Index: 1.618
• Boiling Point: 443.4°C at 760 mmHg
• Flash Point: 221.9°C
• PSA: 91.57000
• Density: 1.47g/cm³
• LogP: 2.10130
• Storage Temp.: 2-8°C
• XLogP3: 1.6
• Hydrogen Bond Donor Count: 1
• Hydrogen Bond Acceptor Count: 5
• Rotatable Bond Count: 2
• Exact Mass: 194.99901420
• Heavy Atom Count: 13
• Complexity: 212

Purity/Quality:

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

5-Thiophen-2-ylisoxazole-3-carboxylicacid ^*data from reagent suppliers

Safty Information:

• Hazard Codes: Xi

MSDS Files:

SDS file from LookChem

Useful:

• Canonical SMILES: C1=CSC(=C1)C2=CC(=NO2)C(=O)O
• Uses: 5-(Thiophen-2-yl)isoxazole-3-carboxylic acid is a reactant in the cell-free formation of RNA granules with low complexity sequence domain proteins.