4-Methyl-1,3-oxazole-5-carbaldehyde

Base Information

• Chemical Name: 4-Methyl-1,3-oxazole-5-carbaldehyde
• CAS No.: 159015-06-2
• Molecular Formula: C₅H₅NO₂
• Molecular Weight: 111.1
• Hs Code.: 2934999090
• European Community (EC) Number: 826-442-1
• DSSTox Substance ID: DTXSID50565432
• Wikidata: Q82450527
• Mol file: 159015-06-2.mol

Synonyms:4-Methyl-1,3-oxazole-5-carbaldehyde;159015-06-2;4-methyloxazole-5-carbaldehyde;4-Methyl-oxazole-5-carbaldehyde;MFCD10700248;4-methyl-5-oxazolecarbaldehyde;SCHEMBL2518777;4-Methyl -5-oxazolecarbaldehyde;4-methyloxazole-5-carboxaldehyde;DTXSID50565432;ANPKYBKHXNFMFD-UHFFFAOYSA-N;AKOS006302304;AT18679;SB33970;AM100307;AS-60244;CS-0309332;EN300-175720;Z1198279990

Chemical Property of 4-Methyl-1,3-oxazole-5-carbaldehyde

Chemical Property:

• Boiling Point: 187.959 °C at 760 mmHg
• PKA: -0.78±0.14(Predicted)
• Flash Point: 67.476 °C
• PSA: 43.10000
• Density: 1.19 g/cm³
• LogP: 0.79550
• Storage Temp.: under inert gas (nitrogen or Argon) at 2-8°C
• XLogP3: 0.5
• Hydrogen Bond Donor Count: 0
• Hydrogen Bond Acceptor Count: 3
• Rotatable Bond Count: 1
• Exact Mass: 111.032028402
• Heavy Atom Count: 8
• Complexity: 94.4

Purity/Quality:

98% ^*data from raw suppliers

4-Methyl-1,3-oxazole-5-carbaldehyde ^*data from reagent suppliers

Safty Information:

• Pictogram(s):  
• Hazard Codes: 

MSDS Files:

SDS file from LookChem

Useful:

• Canonical SMILES: CC1=C(OC=N1)C=O