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Nitisinone

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Nitisinone / CAS : 104206-65-7

Appearance White to brown,Solid UN 0.0
HS 29147000 DG Class 0.0
Synonyms 2-(2-Nitro-4-(Trifluoromethyl)Benzoyl)Cyclohexane-1,3-Dione; Nitisinonum; Orfadin; Nitisinone [Inn]; Nitisinona; Orfadin (Tn); Nitisone; 2-[2-Nitro-4-(Trifluoromethyl)Benzoyl]Cyclohexane-1,3-Dione
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Properties

Summary

Formula
C14H10F3NO5
Molecular Mass
329.22800
Exact Mass
329.05100
PSA
97.03000
Logp
3.25780
IUPAC
2-[2-nitro-4-(trifluoromethyl)benzoyl]cyclohexane-1,3-dione
SMILES
C1CC(=O)C(C(=O)C1)C(=O)C2=C(C=C(C=C2)C(F)(F)F)[N+](=O)[O-]

Attribute classification

Matter Classification
organic
Category
API & Intermediate > Pharmaceutical Raw Materials

Chemical and Physical Properties

Melting Point
129-131°C
Density
1.484±0.06 g/cm3(Predicted)
Boiling Point
486.2±45.0 °C(Predicted)
Flash Point
247.9ºC
Appearance
White to brown,Solid

Export information

HS Code
29147000
Export Rebate
13%
UN No.
0.0
DG-Class
0.0

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