chempirical

Lauryl glucoside

C18H36O6CAS 59122-55-3348.48 g/mol

Open in Covalent MOL file
OOOHOHOHHO
AcetalAlcoholEther

Properties

Molecular formula
C18H36O6
Molar mass
348.48 g/mol
Exact mass
348.2512 Da
Melting point
77–137 °C
logP
1.72Crippen estimate
Polar surface area
99.4 Ų
H-bond donors / acceptors
4 / 6
Rotatable bonds
13
Stereocentres
R, R, S, S, Rin SMILES atom order

Identifiers

CAS number
59122-55-3
SMILES
CCCCCCCCCCCCO[C@@H]1O[C@H](CO)[C@@H](O)[C@H](O)[C@H]1O
InChIKey
PYIDGJJWBIBVIA-UYTYNIKBSA-N
InChI
InChI=1S/C18H36O6/c1-2-3-4-5-6-7-8-9-10-11-12-23-18-17(22)16(21)15(20)14(13-19)24-18/h14-22H,2-13H2,1H3/t14-,15-,16+,17-,18-/m1/s1

Weigh it out

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

Names and synonyms

8 names
  • n-Dodecyl β-D-glucopyranoside
  • β-D-Glucopyranoside, dodecyl
  • Glucoside, dodecyl
  • Dodecyl β-D-glucopyranoside
  • Dodecyl β-D-glucoside
  • AG 12 (carbohydrate)
  • AG 12
  • BDDG

Work with Lauryl glucoside

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

Octyl α-D-glucopyranoside29781-80-4100 % similar Octyl glucoside29836-26-8100 % similar Decyl glucoside58846-77-8100 % similar Hexyl β-D-glucopyranoside59080-45-4100 % similar Nonyl β-D-glucopyranoside69984-73-2100 % similar Dodecyl β-D-maltoside69227-93-685 % similar Decyl β-D-maltopyranoside82494-09-585 % similar N-Heptyl β-D-thioglucoside85618-20-865 % similar

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

Elsewhere

PubChem CAS Common Chemistry NIST WebBook Wikipedia