1-Cycloheptyl-2,2,2-trifluoroethan-1-one

Base Information

• Chemical Name: 1-Cycloheptyl-2,2,2-trifluoroethan-1-one
• CAS No.: 134704-13-5
• Molecular Formula: C9H13F3O
• Molecular Weight: 194.1941296
• DSSTox Substance ID: DTXSID40567824
• Wikidata: Q82453847
• Mol file: 134704-13-5.mol

Synonyms:134704-13-5;1-Cycloheptyl-2,2,2-trifluoroethan-1-one;1-CYCLOHEPTYL-2,2,2-TRIFLUOROETHANONE;Ethanone, 1-cycloheptyl-2,2,2-trifluoro- (9CI);SCHEMBL18791047;DTXSID40567824;AKOS014313398;EN300-1929213

Chemical Property of 1-Cycloheptyl-2,2,2-trifluoroethan-1-one

Chemical Property:

• PSA: 17.07000
• LogP: 3.08820
• XLogP3: 3.7
• Hydrogen Bond Donor Count: 0
• Hydrogen Bond Acceptor Count: 4
• Rotatable Bond Count: 1
• Exact Mass: 194.09184952
• Heavy Atom Count: 13
• Complexity: 178

Purity/Quality:

99% ^*data from raw suppliers

Safty Information:

• Pictogram(s):  
• Hazard Codes: 

MSDS Files:

SDS file from LookChem

Useful:

• Canonical SMILES: C1CCCC(CC1)C(=O)C(F)(F)F