chempirical

1-Docosanol

C22H46OCAS 661-19-8326.61 g/mol

Open in Covalent MOL file
OH
Alcohol

Properties

Molecular formula
C22H46O
Molar mass
326.61 g/mol
Exact mass
326.3549 Da
Melting point
71 °C
Boiling point
180 °C (at 0.22 Torr)
logP
7.80Crippen estimate
Polar surface area
20.2 Ų
H-bond donors / acceptors
1 / 1
Rotatable bonds
20

Identifiers

CAS number
661-19-8
SMILES
CCCCCCCCCCCCCCCCCCCCCCO
InChIKey
NOPFSRXAKWQILS-UHFFFAOYSA-N
InChI
InChI=1S/C22H46O/c1-2-3-4-5-6-7-8-9-10-11-12-13-14-15-16-17-18-19-20-21-22-23/h23H,2-22H2,1H3

Weigh it out

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

Names and synonyms

33 names · show all
  • Docosyl alcohol
  • Behenyl alcohol
  • Behenic alcohol
  • Tadenan
  • IK 2 (alcohol)
  • Docosanol
  • IK 2
  • n-Docosanol
  • Stenol 1822
  • Lanette 22
  • Behenyl 80 alcohol
  • Abreva
  • NAA 422
  • NSC 8407
  • Stenol 1822A
  • Nacol 22-97
  • Kalcohl 22080
  • Kalcol 22080
  • Nacol 22-98
  • Toho BH 65
  • Hainol 22S
  • Conol 2265
  • Conol 2280
  • Kalcohl 220
  • 1-Docosonol
  • Behenyl alc. 80
  • Nacol C 22
  • Nikkol behenyl alcohol 80
  • Ginol 22
  • Ranette 22
  • Kalkol 220-80
  • Nikkol behenyl alcohol 65
  • Behenyl alcohol 65

Work with 1-Docosanol

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-Hexanol111-27-3100 % similar 1-Heptanol111-70-6100 % similar 1-Octanol111-87-5100 % similar 1-Decanol112-30-1100 % similar Undecanol112-42-5100 % similar Dodecanol112-53-8100 % similar 1-Tridecanol112-70-9100 % similar 1-Tetradecanol112-72-1100 % similar

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

Elsewhere

PubChem CAS Common Chemistry NIST WebBook Wikipedia