5-(4-Ethynylphenyl)-1,3-oxazole

Base Information

• Chemical Name: 5-(4-Ethynylphenyl)-1,3-oxazole
• CAS No.: 501944-63-4
• Molecular Formula: C₁₁H₇NO
• Molecular Weight: 169.183
• Hs Code.: 2934999090
• European Community (EC) Number: 640-932-0
• ChEMBL ID: CHEMBL5219344
• DSSTox Substance ID: DTXSID60594470
• Wikidata: Q82489302
• Mol file: 501944-63-4.mol

Synonyms:5-(4-Ethynylphenyl)-1,3-oxazole;501944-63-4;5-(4-ethynylphenyl)oxazole;CHEMBL5219344;SCHEMBL1007903;DTXSID60594470;CYRYZDZQFDRTHD-UHFFFAOYSA-N;BDBM50607376;AKOS006237431;PS-6177;DB-071124;CS-0453068;J-516243

Chemical Property of 5-(4-Ethynylphenyl)-1,3-oxazole

Chemical Property:

• Vapor Pressure: 0.00367mmHg at 25°C
• Melting Point: 75.5-77.5 ºC
• Refractive Index: 1.598
• Boiling Point: 290.1 °C at 760 mmHg
• Flash Point: 116.3 °C
• PSA: 26.03000
• Density: 1.18 g/cm³
• LogP: 2.32290
• XLogP3: 2.2
• Hydrogen Bond Donor Count: 0
• Hydrogen Bond Acceptor Count: 2
• Rotatable Bond Count: 2
• Exact Mass: 169.052763847
• Heavy Atom Count: 13
• Complexity: 209

Purity/Quality:

98% ^*data from raw suppliers

5-(4-Ethynylphenyl)-1,3-oxazole ^*data from reagent suppliers

Safty Information:

• Pictogram(s):  
• Hazard Codes: 

MSDS Files:

SDS file from LookChem

Useful:

• Canonical SMILES: C#CC1=CC=C(C=C1)C2=CN=CO2