chempirical

Batyl alcohol

C21H44O3CAS 544-62-7344.58 g/mol

Open in Covalent MOL file
OOHOH
AlcoholEther

Properties

Molecular formula
C21H44O3
Molar mass
344.58 g/mol
Exact mass
344.3290 Da
Melting point
70.5 °C
Boiling point
215–220 °C (at 2 Torr)
logP
5.62Crippen estimate
Polar surface area
49.7 Ų
H-bond donors / acceptors
2 / 3
Rotatable bonds
20

Identifiers

CAS number
544-62-7
SMILES
CCCCCCCCCCCCCCCCCCOCC(O)CO
InChIKey
OGBUMNBNEWYMNJ-UHFFFAOYSA-N
InChI
InChI=1S/C21H44O3/c1-2-3-4-5-6-7-8-9-10-11-12-13-14-15-16-17-18-24-20-21(23)19-22/h21-23H,2-20H2,1H3

Weigh it out

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

Names and synonyms

27 names · show all
  • 1,2-Propanediol, 3-(octadecyloxy)-
  • 3-(Octadecyloxy)-1,2-propanediol
  • Batilol
  • Glycerol monooctadecyl ether
  • 1-O-Octadecylglycerol
  • Glyceryl-1-octadecyl ether
  • Stearyl monoglyceride
  • 1-Octadecyloxy-2,3-dihydroxypropane
  • Glycerol 1-octadecyl ether
  • 1-Octadecylglycerol
  • α-Monostearyl glyceryl ether
  • rac-1-O-Octadecylglycerol
  • (±)-1-Octadecylglycerol
  • (±)-Batyl alcohol
  • (RS)-Batyl alcohol
  • (±)-3-(Octadecyloxy)-1,2-propanediol
  • 2,3-Dihydroxypropyl octadecyl ether
  • 3-Stearyloxy-1,2-propylene glycol
  • Nikkol batyl alcohol EX
  • Octadecyl-α-glycerol ether
  • NSC 284200
  • NSC 8716
  • Nikkol batyl alcohol 100
  • Batil alcohol
  • Glycerol 1-octdecyl ether
  • 1-Octadecyloxy-2,3-propanediol
  • 3-Octadecoxypropane-1,2-diol

Work with Batyl alcohol

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

Bis(2,3-dihydroxypropyl) ether627-82-762 % similar 1,2-Octanediol1117-86-860 % similar 1,2-Decanediol1119-86-460 % similar 1,2-Dodecanediol1119-87-560 % similar 1,2-Tetradecanediol21129-09-960 % similar 1,2-Hexadecanediol6920-24-760 % similar Ethylhexylglycerin70445-33-959 % similar 1,2-Hexanediol6920-22-553 % similar

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

Elsewhere

PubChem CAS Common Chemistry NIST WebBook