chempirical

1-Chlorododecane

C12H25ClCAS 112-52-7204.78 g/mol

Open in Covalent MOL file
Cl
Alkyl halide

Properties

Molecular formula
C12H25Cl
Molar mass
204.78 g/mol
Exact mass
204.1645 Da
Density
0.8673 g/mL (at 22 °C)
Melting point
−9.3 °C
Boiling point
260 °C
logP
5.15Crippen estimate
Polar surface area
0.0 Ų
H-bond donors / acceptors
0 / 0
Rotatable bonds
10

Identifiers

CAS number
112-52-7
SMILES
CCCCCCCCCCCCCl
InChIKey
YAYNEUUHHLGGAH-UHFFFAOYSA-N
InChI
InChI=1S/C12H25Cl/c1-2-3-4-5-6-7-8-9-10-11-12-13/h2-12H2,1H3

Weigh it out

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

Names and synonyms

7 names
  • Dodecane, 1-chloro-
  • Lauryl chloride
  • Dodecyl chloride
  • n-Dodecyl chloride
  • 1-Dodecyl chloride
  • n-Lauryl chloride
  • NSC 57107

Work with 1-Chlorododecane

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 Boiling point under vacuumAt any pressure, from its normal boiling point Isotope patternExact mass and the mass spectrum pattern

Similar compounds

1-Chlorodecane1002-69-3100 % similar 1-Chlorooctane111-85-3100 % similar 1-Chlorotetradecane2425-54-9100 % similar 1-Chlorononane2473-01-0100 % similar 1-Chlorooctadecane3386-33-2100 % similar 1-Chlorohexadecane4860-03-1100 % similar 1-Chlorohexane544-10-5100 % similar 1-Chloroheptane629-06-1100 % similar

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

Elsewhere

PubChem CAS Common Chemistry NIST WebBook