1-(Isoxazol-5-yl)ethanamine

Base Information

• Chemical Name: 1-(Isoxazol-5-yl)ethanamine
• CAS No.: 933721-75-6
• Molecular Formula: C5H8N2O
• Molecular Weight: 112.13
• Hs Code.: 2934999090
• DSSTox Substance ID: DTXSID30695822
• Mol file: 933721-75-6.mol

Synonyms:1-(Isoxazol-5-yl)ethanamine;933721-75-6;1-ISOXAZOL-5-YL-ETHYLAMINE;1-(1,2-Oxazol-5-yl)ethan-1-amine;1-(1,2-OXAZOL-5-YL)ETHANAMINE;1-Isoxazol-5-ylethylamine;SCHEMBL2187630;DTXSID30695822;AKOS006220906;SB40046;BB 0260552;FT-0709382

Chemical Property of 1-(Isoxazol-5-yl)ethanamine

Chemical Property:

• Boiling Point: 199.1 °C at 760 mmHg
• Flash Point: 74.2 °C
• PSA: 52.05000
• Density: 1.091 g/cm³
• LogP: 1.39460
• XLogP3: -0.3
• Hydrogen Bond Donor Count: 1
• Hydrogen Bond Acceptor Count: 3
• Rotatable Bond Count: 1
• Exact Mass: 112.063662883
• Heavy Atom Count: 8
• Complexity: 76.8

Purity/Quality:

99% ^*data from raw suppliers

1-Isoxazol-5-yl-ethylamine 97% ^*data from reagent suppliers

Safty Information:

• Pictogram(s):  
• Hazard Codes: 

MSDS Files:

SDS file from LookChem

Useful:

• Canonical SMILES: CC(C1=CC=NO1)N