ChemicalBook--->CAS DataBase List--->108789-36-2

108789-36-2

108789-36-2 Structure

108789-36-2 Structure
IdentificationBack Directory
[Name]

5-BROMO-4-CHLORO-3-INDOLYL-ALPHA-D-GLUCOPYRANOSIDE
[CAS]

108789-36-2
[Synonyms]

X-A-GLU
X-ALPHA-GLU
X-ALPHA-D-GLC
X-ALPHA-GLUCOSIDE
X-ALPHA-D-GLUCOSIDE
5-BROMO-4-CHLORO-3-INDOLYL-ALPHA-D-GLUCOSIDE
5-BROMO-4-CHLORO-3-INDOXYL-ALPHA-D-GLUCOPYRANOSIDE
5-BROMO-4-CHLORO-3-INDOLYL-ALPHA-D-GLUCOPYRANOSIDE
5-Bromo-4-chloro-3-indoxyl-alpha-D-glucopyranoside,99%
5-BROMO-4-CHLORO-3-INDOXYL-ALPHA-D- GLUCOPYRANOSIDE 99%
5-Bromo-4-chloro-3-indolyl-alpha-D-glucopyranoside (X-alpha-Glu)
(2R,3R,4S,5S,6R)-2-[(5-Bromo-4-chloro-1H-indol-3-yl)oxy]-6-(hydroxymethyl)tetrahydropyran-3,4,5-triol
[EINECS(EC#)]

1533716-785-6
[Molecular Formula]

C14H15BrClNO6
[MDL Number]

MFCD00155606
[MOL File]

108789-36-2.mol
[Molecular Weight]

408.63
Chemical PropertiesBack Directory
[Appearance]

white to off-white fine crystalline powder
[Boiling point ]

674℃
[density ]

1.882
[refractive index ]

1.6110 (estimate)
[Fp ]

361℃
[storage temp. ]

Store at 4 or below
[form ]

powder
[pka]

12.74±0.70(Predicted)
[color ]

White
[Optical Rotation]

[α]/D 105.0±5.0°, c = 1 in DMF/H2O 1:1
[InChI]

InChI=1/C14H15BrClNO6/c15-5-1-2-6-9(10(5)16)7(3-17-6)22-14-13(21)12(20)11(19)8(4-18)23-14/h1-3,8,11-14,17-21H,4H2/t8-,11-,12+,13-,14+/s3
[InChIKey]

OPIFSICVWOWJMJ-YOKWFQDINA-N
[SMILES]

C12C(Cl)=C(C=CC=1NC=C2O[C@@H]1[C@H](O)[C@H]([C@H](O)[C@@H](CO)O1)O)Br |&1:11,12,14,15,17,r|
Hazard InformationBack Directory
[Chemical Properties]

white to off-white fine crystalline powder
[Uses]

suitable as substrate for α-glucosidase; substrate used in the Druggan-Forsythe-Iversen medium (DFI agar) for the selective detection of Enterobacter sakazakii in infant milk
[Definition]

ChEBI: 5-bromo-4-chloro-3-indolyl alpha-D-glucoside is an indolyl carbohydrate that is the alpha-D-glucoside of indoxyl in which the indole moiety is substituted at positions 4 and 5 by chlorine and bromine, respectively. It is an organobromine compound, an organochlorine compound, an indolyl carbohydrate, a D-aldohexose derivative and an alpha-D-glucoside. It is functionally related to an indoxyl.
[General Description]

5-Bromo-4-chloro-3-indolyl α-D-glucopyranoside, X-Gluc, is a indigogenic substrate for β- glucuronidase enzyme (GUS). It aids screening of transgenic plants based on GUS activity. GUS deesterifies X-Gluc into indoxyl derivative which upon oxidative polymerization results in the generation of blue indigotin dye.
Safety DataBack Directory
[WGK Germany ]

3
[HS Code ]

29400090
[Storage Class]

11 - Combustible Solids
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