chempirical

1-Chloro-5-iodopentane

C5H10ClICAS 60274-60-4232.49 g/mol

Open in Covalent MOL file
ClI
Alkyl halide

Properties

Molecular formula
C5H10ClI
Molar mass
232.49 g/mol
Exact mass
231.9516 Da
Density
1.6731 g/mL (at 20 °C)
Boiling point
75.8 °C (at 4 Torr)
logP
2.83Crippen estimate
Polar surface area
0.0 Ų
H-bond donors / acceptors
0 / 0
Rotatable bonds
4

Identifiers

CAS number
60274-60-4
SMILES
ClCCCCCI
InChIKey
GUUHKOCYWBEGGX-UHFFFAOYSA-N
InChI
InChI=1S/C5H10ClI/c6-4-2-1-3-5-7/h1-5H2

Weigh it out

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

Names and synonyms

3 names
  • Pentane, 1-chloro-5-iodo-
  • 5-Chloro-1-iodopentane
  • 1-Iodo-5-chloropentane

Work with 1-Chloro-5-iodopentane

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-iodohexane34683-73-3100 % similar 1-Chloro-4-iodobutane10297-05-993 % similar 1-Chloro-3-iodopropane6940-76-775 % similar 1,10-Diiododecane16355-92-360 % similar 1,10-Dichlorodecane2162-98-360 % similar 1,8-Dichlorooctane2162-99-460 % similar 1,6-Dichlorohexane2163-00-060 % similar 1,8-Diiodooctane24772-63-260 % similar

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

Elsewhere

PubChem CAS Common Chemistry NIST WebBook