chempirical

1-Chloro-4-iodobutane

C4H8ClICAS 10297-05-9218.46 g/mol

Open in Covalent MOL file
ClI
Alkyl halide

Properties

Molecular formula
C4H8ClI
Molar mass
218.46 g/mol
Exact mass
217.9359 Da
Density
1.7712 g/mL (at 20 °C)
Boiling point
93–94.5 °C (at 17 Torr)
logP
2.44Crippen estimate
Polar surface area
0.0 Ų
H-bond donors / acceptors
0 / 0
Rotatable bonds
3

Identifiers

CAS number
10297-05-9
SMILES
ClCCCCI
InChIKey
JXOSPTBRSOYXGC-UHFFFAOYSA-N
InChI
InChI=1S/C4H8ClI/c5-3-1-2-4-6/h1-4H2

Weigh it out

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

Names and synonyms

7 names
  • Butane, 1-chloro-4-iodo-
  • 1-Iodo-4-chlorobutane
  • 4-Iodobutyl chloride
  • 4-Chloro-1-iodobutane
  • 4-Chlorobutyl iodide
  • 4-Iodo-1-chlorobutane
  • Tetramethylene chloroiodide

Work with 1-Chloro-4-iodobutane

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-6-iodohexane34683-73-393 % similar 1-Chloro-5-iodopentane60274-60-493 % similar 1-Chloro-3-iodopropane6940-76-780 % similar 1,4-Dichlorobutane110-56-557 % similar 1,10-Diiododecane16355-92-353 % similar 1,10-Dichlorodecane2162-98-353 % similar 1,8-Dichlorooctane2162-99-453 % similar 1,6-Dichlorohexane2163-00-053 % similar

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

Elsewhere

PubChem CAS Common Chemistry NIST WebBook