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Tetrodotoxin

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Tetrodotoxin / CAS : 4368-28-9

Appearance White to beige solid UN 3462
HS 30029090 DG Class 6.1(a)
Synonyms Spheroidine; (4R,4Ar,5R,7S,9S,10S,10Ar,11S,12S)-Octahydro-12-(Hydroxymethyl)-2-Imino-5,9:7,10A-Dimethano-10Ah-(1,3)Dioxocino(6,5-D)Pyrimidine-4,7,10,11,12-Pentol; Fugu Poison,Maculotoxin,Ttx; Fugu Toxin; Tetradotoxin; Tetrdotoxin; Maculotoxin
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Properties

Summary

Formula
C11H17N3O8
Molecular Mass
319.26800
Exact Mass
319.10200
PSA
192.32000
Logp
-6.03400
IUPAC
(1R,5R,6R,7R,9S,11S,12S,13S,14S)-3-amino-14-(hydroxymethyl)-8,10-dioxa-2,4-diazatetracyclo[7.3.1.17,11.01,6]tetradec-3-ene-5,9,12,13,14-pentol
SMILES
C(C1(C2C3C(N=C(NC34C(C1OC(C4O)(O2)O)O)N)O)O)O

Attribute classification

Matter Classification
organic
Category
API & Intermediate > Pharmaceutical Raw Materials
Plant and Other Extracts > Animal Extract

Chemical and Physical Properties

Melting Point
225ºC
Density
2.78 g/cm3
Boiling Point
702.6ºC
Flash Point
378.7ºC
Appearance
White to beige solid
Acidity and Basicity
alkalinity

Export information

HS Code
30029090
Export Rebate
13%
UN No.
3462
DG-Class
6.1(a)
Risk Code
R26/27/28
Safety Label
T+

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