ChemicalBook--->CAS DataBase List--->18997-54-1

18997-54-1

18997-54-1 Structure

18997-54-1 Structure
IdentificationBack Directory
[Name]

PHENYLETHYL BETA-D-GLUCOPYRANOSIDE
[CAS]

18997-54-1
[Synonyms]

b-Phenylethyl b-D-Glucoside
β-Phenylethyl β-D-Glucoside
Phenylethyl-b-D-glucopyranoside
PHENYLETHYL BETA-D-GLUCOPYRANOSIDE
(2R,3S,4S,5R,6R)-2-(Hydroxymethyl)-6-phenethoxytetrahydro-2H-pyran-3,4,5-triol
[Molecular Formula]

C14H20O6
[MDL Number]

MFCD04972099
[MOL File]

18997-54-1.mol
[Molecular Weight]

284.3
Chemical PropertiesBack Directory
[Melting point ]

115 - 117°C
[Boiling point ]

486.8±45.0 °C(Predicted)
[density ]

1.36±0.1 g/cm3(Predicted)
[storage temp. ]

Refrigerator, Under Inert Atmosphere
[solubility ]

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

Solid
[pka]

12.92±0.70(Predicted)
[color ]

White to Off-White
[Major Application]

metabolomics
vitamins, nutraceuticals, and natural products
[InChI]

InChI=1S/C14H20O6/c15-8-10-11(16)12(17)13(18)14(20-10)19-7-6-9-4-2-1-3-5-9/h1-5,10-18H,6-8H2/t10-,11-,12+,13-,14-/m1/s1
[InChIKey]

MLRIJUWUQTVDQE-RKQHYHRCSA-N
[SMILES]

O(CCC1=CC=CC=C1)[C@@H]1O[C@H](CO)[C@@H](O)[C@H](O)[C@H]1O
Safety DataBack Directory
[Symbol(GHS) ]


GHS07
[Signal word ]

Warning
[Hazard statements ]

H302
[Precautionary statements ]

P301+P312+P330
[WGK Germany ]

WGK 3
[Storage Class]

11 - Combustible Solids
[Hazard Classifications]

Acute Tox. 4 Oral
Hazard InformationBack Directory
[Chemical Properties]

White Solid
[Uses]

One of the two new glycosides from Conyza bonariensis
[Uses]

One of the two new glycosides from Conyza bonariensis.
[Definition]

ChEBI: Phenylethyl beta-D-glucopyranoside is a glycoside.
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