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125229-64-3

125229-64-3 structural image
Product Name: 5-BROMO-4-CHLORO-3-INDOLYL ALPHA-D-MANNOPYRANOSIDE
Formula: C14H15BrClNO6
Synonyms: X-Man
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SAFETY INFORMATION

Signal word Warning
Pictogram(s)

Exclamation Mark
Irritant
GHS07
GHS Hazard Statements H302:Acute toxicity,oral
Precautionary Statement Codes P280:Wear protective gloves/protective clothing/eye protection/face protection.
P305+P351+P338:IF IN EYES: Rinse cautiously with water for several minutes. Remove contact lenses, if present and easy to do. Continuerinsing.

COMPUTED DESCRIPTORS

Molecular Weight 408.63 g/mol
XLogP3 1.2
Hydrogen Bond Donor Count 5
Hydrogen Bond Acceptor Count 6
Rotatable Bond Count 3
Exact Mass 406.97713 g/mol
Monoisotopic Mass 406.97713 g/mol
Topological Polar Surface Area 115 Ų
Heavy Atom Count 23
Formal Charge 0
Complexity 421
Isotope Atom Count 0
Defined Atom Stereocenter Count 5
Undefined Atom Stereocenter Count 0
Defined Bond Stereocenter Count 0
Undefined Bond Stereocenter Count 0
Covalently-Bonded Unit Count 1
Compound Is Canonicalized Yes

PRODUCT INTRODUCTION

description

5-bromo-4-chloro-3-indolyl alpha-D-mannoside is an indolyl carbohydrate that is the alpha-D-mannoside of indoxyl in which the indole moiety is substituted at positions 4 and 5 by chlorine and bromine, respectively It has a role as a chromogenic compound. It is an organobromine compound, an organochlorine compound, an indolyl carbohydrate, a D-aldohexose derivative and an alpha-D-mannoside. It is functionally related to an indoxyl.