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Inositol Nicotinate

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Inositol Nicotinate / CAS : 6556-11-2

Appearance White powder UN 0.0
HS 29333990 DG Class 0.0
Synonyms Myo-Inositol Hexanicotinate; Inositol Hexanicotinate; Hexanicotinate, Myo-Inosito; [2,3,4,5,6-Pentakis(Pyridine-3-Carbonyloxy)Cyclohexyl] Pyridine-3-Carboxylate; Hexanicotol-cis-1.2.3.5-Trans-4.6-Cyclonexane; Inositol Niacinate; Hexanicotol
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Properties

Summary

Formula
C42H30N6O12
Molecular Mass
810.72100
Exact Mass
810.19200
PSA
235.14000
Logp
3.72360
IUPAC
[2,3,4,5,6-pentakis(pyridine-3-carbonyloxy)cyclohexyl] pyridine-3-carboxylate
SMILES
C1=CC(=CN=C1)C(=O)OC2C(C(C(C(C2OC(=O)C3=CN=CC=C3)OC(=O)C4=CN=CC=C4)OC(=O)C5=CN=CC=C5)OC(=O)C6=CN=CC=C6)OC(=O)C7=CN=CC=C7

Attribute classification

Matter Classification
organic
Category
API & Intermediate > Pharmaceutical Raw Materials

Chemical and Physical Properties

Melting Point
254-256ºC
Density
1.5g/cm3
Boiling Point
897ºC
Flash Point
496.3ºC
Appearance
White powder
Acidity and Basicity
alkalinity

Export information

HS Code
29333990
Export Rebate
13%
UN No.
0.0
DG-Class
0.0
Risk Code
R36/37/38
Safety Label
Xi

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