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107021-38-5

107021-38-5 Structure

107021-38-5 Structure
IdentificationMore
[Name]

5-Bromo-4-chloro-3-indolyl-alpha-D-galactopyranoside
[CAS]

107021-38-5
[Synonyms]

5-BROMO-4-CHLORO-3-INDOLYL-ALPHA-D-GALACTOPYRANOSIDE
5-BROMO-4-CHLORO-3-INDOLYL-ALPHA-D-GALACTOSIDE
5-BROMO-4-CHLORO-3-INDOXYL-ALPHA-D-GALACTOPYRANOSIDE
ALPHA-X-GAL
RARECHEM AH BS 0009
X-A-GAL
X-ALPHA-D-GAL
X-ALPHA-D-GALACTOSIDE
X-ALPHA-GAL
5-BROMO-4-CHLORO-3-INDOLYL-ALPHA-D-GALACTOPYRANOSIDE (X-ALPHA-GAL)
5-Bromo-4-chloro-3-indolyl-alpha-D-galactoside >98%
5-Bromo-4-chloro-3-indolyl-alpha-D-galactopyranoside (X-alpha-ga
[EINECS(EC#)]

1533716-785-6
[Molecular Formula]

C14H15BrClNO6
[MDL Number]

MFCD00063780
[Molecular Weight]

408.63
[MOL File]

107021-38-5.mol
Chemical PropertiesBack Directory
[Melting point ]

230℃ (dec.)
[alpha ]

+142~+149
[Boiling point ]

673.9±55.0 °C(Predicted)
[density ]

1.882±0.06 g/cm3(Predicted)
[storage temp. ]

Store at 4 or below
[solubility ]

DMF: 3 mg/ml; DMSO: 14 mg/ml; Ethanol: Slightly soluble; PBS (pH 7.2): 0.25 mg/ml
[form ]

White to off-white solid
[pka]

12.74±0.70(Predicted)
[color ]

White to light yellow
[Optical Rotation]

[α]/D 135.0±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-ZQYXXTRKNA-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|
[CAS DataBase Reference]

107021-38-5(CAS DataBase Reference)
Safety DataBack Directory
[Symbol(GHS) ]

Exclamation Mark (GHS07)
GHS07
[Signal word ]

Warning
[Hazard statements ]

H315-H319-H335
[Precautionary statements ]

P261-P271-P280
[WGK Germany ]

3
[HS Code ]

29400090
[Storage Class]

11 - Combustible Solids
Hazard InformationBack Directory
[Chemical Properties]

White to off-white powder
[Uses]

Substrate for beta-galactosidase
[Definition]

ChEBI: 5-bromo-4-chloro-3-indolyl alpha-D-galactoside is an indolyl carbohydrate that is the alpha-D-galactoside 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-galactoside. It is functionally related to an indoxyl.
Spectrum DetailBack Directory
[Spectrum Detail]

5-Bromo-4-chloro-3-indolyl-alpha-D-galactopyranoside(107021-38-5)1HNMR
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