2-[2,2,2-Trifluoro-1-(nitromethyl)ethyl]cyclohexanone

CAS Registry Number®

112092-00-9
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CAS Name

2-[2,2,2-Trifluoro-1-(nitromethyl)ethyl]cyclohexanone

Molecular Formula

C9H12F3NO3

Molecular Mass

239.19

Cite this Page

2-[2,2,2-Trifluoro-1-(nitromethyl)ethyl]cyclohexanone.   CAS Common Chemistry.   CAS, a division of the American Chemical Society, n.d.   http://commonchemistry.cas.org/detail?cas_rn=112092-00-9 (retrieved 2024-08-14) (CAS RN: 112092-00-9).  Licensed under the Attribution-Noncommercial 4.0 International License (CC BY-NC 4.0).

Compound Properties

  • Boiling Point (1)

    131 °C @ Press: 3 Torr

Source(s)

  • (1) Denotes property values from the ZIC/VINITI data file provided by InfoChem.

Other Names and Identifiers

InChI

InChI=1S/C9H12F3NO3/c10-9(11,12)7(5-13(15)16)6-3-1-2-4-8(6)14/h6-7H,1-5H2

InChIKey

InChIKey=OIKQDKNGGZIECX-UHFFFAOYSA-N

SMILES

C(CN(=O)=O)(C(F)(F)F)C1C(=O)CCCC1

Canonical SMILES

O=C1CCCCC1C(CN(=O)=O)C(F)(F)F

Other Names for this Substance

  • Cyclohexanone, 2-[2,2,2-trifluoro-1-(nitromethyl)ethyl]-
  • 2-[2,2,2-Trifluoro-1-(nitromethyl)ethyl]cyclohexanone
  • 2-(1,1,1-Trifluoro-3-nitropropan-2-yl)cyclohexan-1-one
  • 2-(1-Trifluoromethyl-2-nitroethyl)cyclohexanone