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Basic Information
CAS No.: 29836-26-8
Name: Octyl-beta-D-glucopyranoside
Molecular Structure:
Molecular Structure of 29836-26-8 (Octyl-beta-D-glucopyranoside)
Formula: C14H28O6
Molecular Weight: 292.373
Synonyms: Glucopyranoside,octyl, b-D- (8CI);1-O-Octyl-b-D-glucopyranose;1-O-Octyl-b-D-glucopyranoside;1-O-n-Octyl-b-D-glucopyranoside;1-Octyl b-D-glucopyranoside;1-Octyl b-D-glucoside;1-n-Octyl b-D-glucopyranoside;BTB 11967;Octyl glucoside;Octyl b-D-glucoside;Octyl b-D-glycopyranoside;Octyl b-glucopyranoside;n-Octyl b-D-glucopyranoside;n-Octyl b-D-glucoside;b-D-Octyl glucoside;b-Octyl monoglucoside;
EINECS: 249-887-8
Density: 1.18 g/cm3
Melting Point: 105 °C
Boiling Point: 454.1 °C at 760 mmHg
Flash Point: 228.4 °C
Solubility: 3 g/10 mL in water
Risk Codes: 36/37/38
Safety: 24/25
PSA: 99.38000
LogP: 0.16340
Synthetic route
38954-67-5

octyl (2,3,4,6-tetra-O-acetyl)-β-D-glucopyranoside

29836-26-8

n-octyl β-D-glucopyranoside

Conditions
ConditionsYield
With sodium methylate In methanol at 20℃; for 3h; Zemplen reaction;100%
With sodium methylate In methanol for 2h; Ambient temperature;99%
With sodium methylate In methanol at 20℃; Inert atmosphere;91%
492-61-5

β-D-glucose

111-87-5

octanol

29836-26-8

n-octyl β-D-glucopyranoside

Conditions
ConditionsYield
With citrate buffer; Aerosol-OT; β-glucosidase In octane at 20℃; for 120h; pH=5.5;40%
With almond meal In water at 50℃; for 168h; Thermodynamic data; Equilibrium constant; Enzymatic reaction;4.05%
With almond meal cross-linked with glutaraldehyde In water at 50℃; for 168h; Equilibrium constant; Enzymatic reaction;
2280-44-6

D-Glucose

111-87-5

octanol

A

29781-80-4

octyl alpha-D-glucopyranoside

B

29836-26-8

n-octyl β-D-glucopyranoside

Conditions
ConditionsYield
With sulfuric acid In 1,4-dioxane Yields of byproduct given;A 30%
B n/a
With boron trifluoride diethyl etherate In tetrahydrofuran for 55h; Ambient temperature; Yield given. Yields of byproduct given;
With acetyl chloride at 120℃; for 0.333333h; microwave irradiation;
2280-44-6

D-Glucose

111-87-5

octanol

29836-26-8

n-octyl β-D-glucopyranoside

Conditions
ConditionsYield
With immobilized β-glucosidase G 0395 from almonds (EC 3.2.1.21) In water at 20℃; for 144h;18%
With almond β-glucosidase immobilised with ENTP-4000 In water at 50℃; for 96h;8.2%
In water; acetonitrile at 40℃; for 72h; 90percent CH3CN, almond β-D-glucosidase; Yield given;
With almond β-D-glycosidase immobilized on Amberlite XAD-4; sodium chloride In acetonitrile at 50℃; Kinetics; Further Variations:; Solvents; Reaction partners; Enzymatic reaction;
With almond β-glucosidase immobilized on Amberlite XAD-4; barium(II) chloride In N,N-dimethyl-formamide at 50℃; Enzymatic reaction;
111-87-5

octanol

50-99-7

D-glucose

29836-26-8

n-octyl β-D-glucopyranoside

Conditions
ConditionsYield
With Amberlite IR-120 (H+) resin for 0.133333h; Microwave irradiation;15%
With β-glucosidase immobilized on polyamine microspheres In aq. phosphate buffer; tert-butyl alcohol at 50℃; for 48h; pH=6; Catalytic behavior; Kinetics; Concentration; Reagent/catalyst; Solvent; Enzymatic reaction;
With recombinant β-glucosidase from Microcerotermes annandalei In aq. phosphate buffer at 30℃; for 144h;
111-87-5

octanol

1464-44-4

phenyl-β-D-glucopyranoside

29836-26-8

n-octyl β-D-glucopyranoside

Conditions
ConditionsYield
With phosphate buffer; lactase from Kluyveromyces lactis In nitrobenzene at 50℃; for 1h;13%
111-87-5

octanol

A

50-99-7

D-glucose

B

29781-80-4

octyl alpha-D-glucopyranoside

C

498-07-7

levoglucosan

D

butyl-D-glucofuranoside

E

29836-26-8

n-octyl β-D-glucopyranoside

Conditions
ConditionsYield
With Amberlyst 15DRY at 110℃; for 24h; Sealed vial; Ionic liquid;A 15 %Chromat.
B 38 %Chromat.
C 10%
D 6%
E 21 %Chromat.
111-87-5

octanol

2492-87-7

4-nitrophenyl-β-D-glucoside

29836-26-8

n-octyl β-D-glucopyranoside

Conditions
ConditionsYield
With phosphate buffer; β-glucosidase at 30℃; for 17h; pH=5;2%
With water; almond β-glucosidase In acetate buffer; N,N-dimethyl-formamide at 50℃; pH=5.0; Kinetics; Further Variations:; Solvents; enzyme immobilized on Celite R640<*>;
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Chemistry

Product Name: beta-D-Glucopyranoside, octyl (CAS NO.29836-26-8)

Molecular Formula: C14H28O6
Molecular Weight: 292.37g/mol
Mol File: 29836-26-8.mol
EINECS: 249-887-8
Appearance: white crystalline powder and chunks
Index of Refraction: 1.515 
Molar Refractivity: 74.33 cm3 
Molar Volume: 246.2 cm3 
Surface Tension: 51.5 dyne/cm 
Density: 1.18 g/cm
Flash Point: 228.4 °C 
Enthalpy of Vaporization: 82.32 kJ/mol 
Boiling Point: 454.1 °C at 760 mmHg 
Vapour Pressure: 3.72E-10 mmHg at 25°C
XLogP3-AA: 1.4
H-Bond Donor: 4
H-Bond Acceptor: 6
Structure Descriptors of beta-D-Glucopyranoside, octyl (CAS NO.29836-26-8):
  IUPAC Name: (2R,3S,4S,5R,6R)-2-(hydroxymethyl)-6-octoxyoxane-3,4,5-triol
  Canonical SMILES: CCCCCCCCOC1C(C(C(C(O1)CO)O)O)O
  Isomeric SMILES: CCCCCCCCO[C@H]1[C@@H]([C@H]([C@@H]([C@H](O1)CO)O)O)O
  InChI: InChI=1S/C14H28O6/c1-2-3-4-5-6-7-8-19-14-13(18)12(17)11(16)10(9-15)20-14/h10-18H,2-9H2,1H3/t10-,11-,12+,13-,14-/m1/s1 
  InChIKey: HEGSGKPQLMEBJL-RKQHYHRCSA-N
Product Categories: Biochemistry; Glucose; Glycosides; Sugars; Nonionic Surfactants (for Biochemistry); Surfactants (for Biochemistry)

Safety Profile

Safety Information of beta-D-Glucopyranoside, octyl (CAS NO.29836-26-8):
Risk Statements: 36/37/38 
R36/37/38:Irritating to eyes, respiratory system and skin.
Safety Statements: 24/25 
S24/25:Avoid contact with skin and eyes.
WGK Germany: 3

Specification

 beta-D-Glucopyranoside, octyl , its CAS NO. is 29836-26-8, the synonyms are Octyl-beta-D-glucoside ; 1-O-Octyl-beta-D-glucopyranoside .