Ethyl 5-(2-methylpropyl)-1,2-oxazole-3-carboxylate

Base Information

• Chemical Name: Ethyl 5-(2-methylpropyl)-1,2-oxazole-3-carboxylate
• CAS No.: 110578-27-3
• Molecular Formula: C₁₀H₁₅NO₃
• Molecular Weight: 197.234
• Hs Code.: 2934999090
• DSSTox Substance ID: DTXSID90548587
• Wikidata: Q72496148
• Mol file: 110578-27-3.mol

Synonyms:110578-27-3;Ethyl 5-isobutylisoxazole-3-carboxylate;ethyl 5-(2-methylpropyl)-1,2-oxazole-3-carboxylate;5-(2-METHYLPROPYL)-3-ISOXAZOLECARBOXYLIC ACID ETHYL ESTER;DTXSID90548587;MFCD08701220;AKOS003673449;LS-09341

Chemical Property of Ethyl 5-(2-methylpropyl)-1,2-oxazole-3-carboxylate

Chemical Property:

• Vapor Pressure: 0.002mmHg at 25°C
• Boiling Point: 292.747°C at 760 mmHg
• PKA: -5.08±0.50(Predicted)
• Flash Point: 130.849°C
• PSA: 52.33000
• Density: 1.06g/cm³
• LogP: 2.04980
• XLogP3: 2.5
• Hydrogen Bond Donor Count: 0
• Hydrogen Bond Acceptor Count: 4
• Rotatable Bond Count: 5
• Exact Mass: 197.10519334
• Heavy Atom Count: 14
• Complexity: 194

Purity/Quality:

98%min ^*data from raw suppliers

Ethyl5-isobutylisoxazole-3-carboxylate 95+% ^*data from reagent suppliers

Safty Information:

• Pictogram(s):  
• Hazard Codes: 

MSDS Files:

SDS file from LookChem

Useful:

• Canonical SMILES: CCOC(=O)C1=NOC(=C1)CC(C)C