2-methyl-5-(trifluoromethyl)-1,3-oxazole-4-carboxylic Acid

Base Information

• Chemical Name: 2-methyl-5-(trifluoromethyl)-1,3-oxazole-4-carboxylic Acid
• CAS No.: 18955-88-9
• Molecular Formula: C6H4 F3 N O3
• Molecular Weight: 195.098
• Hs Code.: 2934999090
• European Community (EC) Number: 671-244-9
• DSSTox Substance ID: DTXSID30379635
• Wikidata: Q82169526
• Mol file: 18955-88-9.mol

Synonyms:18955-88-9;2-methyl-5-(trifluoromethyl)-1,3-oxazole-4-carboxylic Acid;2-Methyl-5-(trifluoromethyl)oxazole-4-carboxylic acid;2-methyl-5-trifluoromethyloxazole-4-carboxylic acid;SCHEMBL569207;4-Carboxy-2-methyl-5-(trifluoromethyl)-1,3-oxazole;DTXSID30379635;MFCD01941318;AKOS006230217;AT29267;PS-6696;CS-0316382;FT-0676497;2-methyl-5-trifluoromethyl-4-oxazolecarboxylic acid;2-methyl-5(trifluoromethyl)-oxazole-4-carboxylic acid;2-Methyl-5-(trifluoromethyl)-4-oxazolecarboxylic acid;2-methyl-5-trifluoromethyl-oxazole-4-carboxylic acid;2-methyl-5-(trifluoromethyl)-oxazole-4-carboxylic acid;2-methyl-5-(trifluoromethyl)oxazole-4-carboxylic acid, AldrichCPR

Chemical Property of 2-methyl-5-(trifluoromethyl)-1,3-oxazole-4-carboxylic Acid

Chemical Property:

• Vapor Pressure: 0.00477mmHg at 25°C
• Melting Point: 61-64
• Refractive Index: 1.512
• Boiling Point: 276.5°C at 760 mmHg
• PKA: 2.51±0.36(Predicted)
• Flash Point: 119°C
• PSA: 43.37000
• Density: 1.126g/cm³
• LogP: 1.17660
• XLogP3: 1.5
• Hydrogen Bond Donor Count: 1
• Hydrogen Bond Acceptor Count: 7
• Rotatable Bond Count: 1
• Exact Mass: 195.01432748
• Heavy Atom Count: 13
• Complexity: 218

Purity/Quality:

98%min ^*data from raw suppliers

2-Methyl-5-(trifluoromethyl)-1,3-oxazole-4-carboxylicAcid ^*data from reagent suppliers

Safty Information:

• Hazard Codes: Xi

MSDS Files:

SDS file from LookChem

Useful:

• Canonical SMILES: CC1=NC(=C(O1)C(F)(F)F)C(=O)O