chempirical

1-Chloro-1,1,2-trifluoro-2-iodoethane

C2HClF3ICAS 354-26-7244.38 g/mol

Open in Covalent MOL file
FIFFCl
Alkyl halide

Properties

Molecular formula
C2HClF3I
Molar mass
244.38 g/mol
Exact mass
243.8764 Da
Density
2.181 g/mL (at 20 °C)
Boiling point
77 °C (at 630 Torr)
logP
2.55Crippen estimate
Polar surface area
0.0 Ų
H-bond donors / acceptors
0 / 0
Rotatable bonds
1

Identifiers

CAS number
354-26-7
SMILES
FC(I)C(F)(F)Cl
InChIKey
XONGRFUEHPBOBB-UHFFFAOYSA-N
InChI
InChI=1S/C2HClF3I/c3-2(5,6)1(4)7/h1H

Weigh it out

Type any one amount. The others follow from the molar mass and density.

Names and synonyms

3 names
  • Ethane, 1-chloro-1,1,2-trifluoro-2-iodo-
  • 1-Iodo-2-chloro-1,2,2-trifluoroethane
  • 1-Chloro-2-iodo-1,1,2-trifluoroethane

Work with 1-Chloro-1,1,2-trifluoro-2-iodoethane

Predict the NMR spectrum1H and 13C shifts with multiplicities Make a solutionWhat to weigh for any molarity and volume Check drug-likenessLipinski, Veber and lead-likeness Isotope patternExact mass and the mass spectrum pattern

Similar compounds

1-Chloro-1,1,2,2-tetrafluoroethane354-25-648 % similar 1,2-Dichloro-1,1,2-trifluoroethane354-23-443 % similar 1,2,2-Trichloro-1,1-difluoroethane354-21-241 % similar 2-Chloro-2,2-difluoro-1,1-ethanediol63034-47-939 % similar

Tanimoto similarity of circular fingerprints over the whole catalogue. All similar compounds

Elsewhere

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