Ethyl 2-([(trifluoromethyl)sulphonyl]oxy)pentanoate

Base Information

• Chemical Name: Ethyl 2-([(trifluoromethyl)sulphonyl]oxy)pentanoate
• CAS No.: 109684-05-1
• Molecular Formula: C8H13F3O5S
• Molecular Weight: 278.249
• DSSTox Substance ID: DTXSID90554729
• Mol file: 109684-05-1.mol

Synonyms:109684-05-1;ethyl 2-([(trifluoromethyl)sulphonyl]oxy)pentanoate;Ethyl 2-(((Trifluoromethyl)sulfonyl)oxy)pentanoate;SCHEMBL9327185;DTXSID90554729;QQGABBCSGGJCFO-UHFFFAOYSA-N;Ethyl 2-[(trifluoromethanesulfonyl)oxy]pentanoate

Chemical Property of Ethyl 2-([(trifluoromethyl)sulphonyl]oxy)pentanoate

Chemical Property:

• Boiling Point: 263.1±40.0 °C(Predicted)
• PSA: 78.05000
• Density: 1.336±0.06 g/cm3(Predicted)
• LogP: 2.66520
• XLogP3: 2.4
• Hydrogen Bond Donor Count: 0
• Hydrogen Bond Acceptor Count: 8
• Rotatable Bond Count: 7
• Exact Mass: 278.04357917
• Heavy Atom Count: 17
• Complexity: 343

Purity/Quality:

Safty Information:

• Pictogram(s):  
• Hazard Codes: 

MSDS Files:

Useful:

• Canonical SMILES: CCCC(C(=O)OCC)OS(=O)(=O)C(F)(F)F
• Uses: Ethyl 2-(((Trifluoromethyl)sulfonyl)oxy)pentanoate is an intermediate for the synthesis of (R)-N-(1-Carboxyethyl)-D-norvaline 1-Ethyl Ester (C178075), which is an intermediate in the synthesis of Perindoprilat (P287530), an angiotensin-converting enzyme (ACE) inhibitor. Antihypertensive.