4-Fluoro-4-methyl-2-(pent-4-enamido)pentanoic acid

Base Information

• Chemical Name: 4-Fluoro-4-methyl-2-(pent-4-enamido)pentanoic acid
• CAS No.: 848949-88-2
• Molecular Formula: C11H18FNO3
• Molecular Weight: 231.26400
• European Community (EC) Number: 639-768-2
• Mol file: 848949-88-2.mol

Synonyms:4-Fluoro-4-methyl-2-(pent-4-enamido)pentanoic acid;848949-88-2;4-fluoro-4-methyl-2-(pent-4-enoylamino)pentanoic acid;SCHEMBL14066054;CS-M2141;AKOS037650303;CS-14608;C12573;4-Fluoro-4-methyl-2-(pent-4-enamido)pentanoicacid

Chemical Property of 4-Fluoro-4-methyl-2-(pent-4-enamido)pentanoic acid

Chemical Property:

• Melting Point: 69-71 °C
• Boiling Point: 412.3±45.0 °C(Predicted)
• PKA: 3.53±0.10(Predicted)
• PSA: 66.40000
• Density: 1.092±0.06 g/cm3(Predicted)
• LogP: 2.05110
• XLogP3: 1.5
• Hydrogen Bond Donor Count: 2
• Hydrogen Bond Acceptor Count: 4
• Rotatable Bond Count: 7
• Exact Mass: 231.12707160
• Heavy Atom Count: 16
• Complexity: 276

Purity/Quality:

≥95% ^*data from raw suppliers

4-Fluoro-N-(1-oxo-4-pentenyl)leucine ^*data from reagent suppliers

Safty Information:

• Pictogram(s):  
• Hazard Codes: 

MSDS Files:

Useful:

• Canonical SMILES: CC(C)(CC(C(=O)O)NC(=O)CCC=C)F