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2-(Trifluoroacetyl)cycloheptanone
[CAS# 82726-77-0]

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Identification
Name 2-(Trifluoroacetyl)cycloheptanone
Synonyms 2-(2,2,2-trifluoroacetyl)cycloheptanone; TOS-BB-0350
Molecular Structure CAS#: 82726-77-0, 2-(Trifluoroacetyl)cycloheptanone
Molecular Formula C9H11F3O2
Molecular Weight 208.18
CAS Registry Number 82726-77-0
SMILES O=C1C(C(=O)C(F)(F)F)CCCCC1
InChI 1S/C9H11F3O2/c10-9(11,12)8(14)6-4-2-1-3-5-7(6)13/h6H,1-5H2
InChIKey WMDLGLZRZCXLSM-UHFFFAOYSA-N
Properties
Density 1.237g/cm3 (Cal.)
Boiling point 240.453°C at 760 mmHg (Cal.)
34-36°C (Expl.)
Flash point 81.917°C (Cal.)
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