5-Isopropyl-3-isoxazolol

Base Information

• Chemical Name: 5-Isopropyl-3-isoxazolol
• CAS No.: 10004-47-4
• Molecular Formula: C₆H₉NO₂
• Molecular Weight: 127.143
• European Community (EC) Number: 828-226-2
• Nikkaji Number: J1.278.570D
• Mol file: 10004-47-4.mol

Synonyms:10004-47-4;5-isopropyl-3-isoxazolol;3(2H)-Isoxazolone, 5-(1-methylethyl)-;5-propan-2-yl-1,2-oxazol-3-one;5-isopropyl-isoxazol-3-ol;5-Isopropylisoxazol-3(2H)-one;5-(1-methylethyl)-3(2H)-Isoxazolone;starbld0042399;SCHEMBL99068;SCHEMBL15631196;EN300-1666398;5-(propan-2-yl)-2,3-dihydro-1,2-oxazol-3-one

Chemical Property of 5-Isopropyl-3-isoxazolol

Chemical Property:

• PSA: 46.26000
• LogP: 1.50360
• XLogP3: 0.9
• Hydrogen Bond Donor Count: 1
• Hydrogen Bond Acceptor Count: 2
• Rotatable Bond Count: 1
• Exact Mass: 127.063328530
• Heavy Atom Count: 9
• Complexity: 160

Purity/Quality:

98%,99%, ^*data from raw suppliers

Safty Information:

• Pictogram(s):  
• Hazard Codes: 

MSDS Files:

SDS file from LookChem

Useful:

• Canonical SMILES: CC(C)C1=CC(=O)NO1