ChemicalBook--->CAS DataBase List--->4304-12-5

4304-12-5

4304-12-5 Structure

4304-12-5 Structure
IdentificationBack Directory
[Name]

BENZYL ALPHA-D-GLUCOPYRANOSIDE
[CAS]

4304-12-5
[Synonyms]

β-Benzyl glucoside
Benzyl alcohol glucoside
Benzyla-D-Glucopyranoside
benzyl B-D-glucopyranoside
Benzyl-O-β-D-glucopyranoside
BENZYL ALPHA-D-GLUCOPYRANOSIDE
Analpha-betamixturecontainingabout80%alpha
Benzyl-a-D-glucopyranoside contains ca 80% a anomer
(2R,3R,4S,5S,6R)-2-(benzyloxy)-6-methylol-tetrahydropyran-3,4,5-triol
(2R,3S,4S,5R,6R)-2-(hydroxymethyl)-6-(phenylmethoxy)oxane-3,4,5-triol
BENZYL ALPHA-D-GLUCOPYRANOSIDE (ALPHA-BETA MIXTURE CONTAINING ABOUT 80% ALPHA)
[Molecular Formula]

C13H18O6
[MDL Number]

MFCD04038133
[MOL File]

4304-12-5.mol
[Molecular Weight]

270.28
Chemical PropertiesBack Directory
[Appearance]

White Powder
[Melting point ]

95-103°C
[Boiling point ]

480.2±45.0 °C(Predicted)
[density ]

1.40±0.1 g/cm3(Predicted)
[storage temp. ]

-20°C Freezer
[solubility ]

Methanol (Slightly), Water (Slightly)
[form ]

Solid
[pka]

12.93±0.70(Predicted)
[color ]

White to Off-White
[Major Application]

metabolomics
vitamins, nutraceuticals, and natural products
[InChI]

1S/C13H18O6/c14-6-9-10(15)11(16)12(17)13(19-9)18-7-8-4-2-1-3-5-8/h1-5,9-17H,6-7H2/t9-,10-,11+,12-,13-/m1/s1
[InChIKey]

GKHCBYYBLTXYEV-UJPOAAIJSA-N
[SMILES]

O[C@H]1[C@@H](O[C@@H]([C@H]([C@@H]1O)O)CO)OCC2=CC=CC=C2
Hazard InformationBack Directory
[Chemical Properties]

White Powder
[Uses]

metabolomics
vitamins, nutraceuticals, and natural products
[Definition]

ChEBI: Benzyl beta-D-glucopyranoside is a beta-D-glucoside that is beta-D-glucopyranose in which the hydroxy group at position 1R is substituted by a benzyloxy group. It has a role as a plant metabolite. It is a beta-D-glucoside and a member of benzenes.
Safety DataBack Directory
[WGK Germany ]

WGK 3
[HS Code ]

29389090
[Storage Class]

11 - Combustible Solids
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