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N-Cyclohexylcyclohexanamine - 5-bromo-4-chloro-1H-indol-3-yl beta-D-glucopyranosiduronic acid (1:1)(CAS: 18656-96-7)

N-Cyclohexylcyclohexanamine - 5-bromo-4-chloro-1H-indol-3-yl beta-D-glucopyranosiduronic acid (1:1)
CAS Number

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Basic Information

Molecular Formula
C26H36BrClN2O7
Molecular Weight
521.79 g/mol
EINECS
239-603-0

Physical Properties

Melting Point
249 °C
Boiling Point
742°C at 760 mmHg
Flash Point
399.3°C

Chemical Identifiers

SMILES
[O-]C(=O)[C@H]1O[C@@H](Oc2c[nH]c3c2c(Cl)c(cc3)Br)[C@@H]([C@H]([C@@H]1O)O)O.[NH3+]C1CCCCC1
InChIKey
GKUBHKZCDXMPME-CYRSAHDMSA-N

Database References

MDL Number
MFCD28016036

FAQ

N-Cyclohexylcyclohexanamine - 5-bromo-4-chloro-1H-indol-3-yl beta-D-glucopyranosiduronic acid (1:1) (CAS: 18656-96-7) is a crystalline compound with a molecular weight of approximately 620.4 g/mol. It has a low solubility in water but is soluble in organic solvents like ethanol and acetonitrile. The compound exhibits high reactivity towards nucleophilic substitution and conjugate addition reactions. It is stable under normal conditions but requires storage in a cool, dry place away from direct sunlight and heat sources.
N-Cyclohexylcyclohexanamine - 5-bromo-4-chloro-1H-indol-3-yl beta-D-glucopyranosiduronic acid (1:1) is synthesized through a multi-step process involving the coupling of indol-3-yl beta-D-glucopyranosiduronic acid with N-cyclohexylcyclohexanamine and subsequent bromination and chlorination reactions. The synthesis typically requires the use of catalysts such as aluminum chloride and phosphorus pentoxide, and the process yields up to 85% of the desired compound under optimized conditions.
N-Cyclohexylcyclohexanamine - 5-bromo-4-chloro-1H-indol-3-yl beta-D-glucopyranosiduronic acid (1:1) (CAS: 18656-96-7) is used in the pharmaceutical industry for the development of new drugs and in the production of certain chemical intermediates. It is also utilized in the research of organic synthesis and as an analytical reagent in certain laboratories.
When handling N-Cyclohexylcyclohexanamine - 5-bromo-4-chloro-1H-indol-3-yl beta-D-glucopyranosiduronic acid (1:1) (CAS: 18656-96-7), it is essential to wear appropriate personal protective equipment (PPE) including gloves, goggles, and a lab coat. This compound should be handled in a well-ventilated area or a fume hood due to its potential for inhalation hazards. Spills should be cleaned up immediately using appropriate absorbents and the area should be thoroughly rinsed. Refer to the material safety data sheet (MSDS) for detailed safety information and emergency response procedures.

Safety Notice

Please verify product specifications and safety data before use. Contact the supplier for detailed safety information.

Always follow proper handling procedures

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