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138182-20-4

138182-20-4 structural image
Product Name: (6-Chloro-3-indolyl)-β-D-glucuronide cyclohexylammonium salt
Formula: C20H27ClN2O7
Synonyms: RED-GLUC;Rose-glucuronide CHA salt;Salmon-glucuronide CHA salt
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SAFETY INFORMATION

Signal word Warning
Pictogram(s)

Exclamation Mark
Irritant
GHS07
GHS Hazard Statements H315:Skin corrosion/irritation
H319:Serious eye damage/eye irritation
H335:Specific target organ toxicity, single exposure;Respiratory tract irritation
Precautionary Statement Codes P261:Avoid breathing dust/fume/gas/mist/vapours/spray.
P271:Use only outdoors or in a well-ventilated area.
P280:Wear protective gloves/protective clothing/eye protection/face protection.

COMPUTED DESCRIPTORS

Molecular Weight 442.9 g/mol
Hydrogen Bond Donor Count 6
Hydrogen Bond Acceptor Count 8
Rotatable Bond Count 3
Exact Mass 442.1506789 g/mol
Monoisotopic Mass 442.1506789 g/mol
Topological Polar Surface Area 158 Ų
Heavy Atom Count 30
Formal Charge 0
Complexity 499
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 2
Compound Is Canonicalized Yes