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4368-28-9 Tetrodotoxin

product Name Tetrodotoxin
CAS No 4368-28-9
Synonyms (1R,5S,6R,7S,9S,11S,12S,13S,14S)-3-amino-5,9,12,13,14-pentahydroxy-14-(hydroxymethyl)-8,10-dioxa-2-aza-4-azoniatetracyclo[7.3.1.1~7,11~.0~1,6~]tetradec-3-ene (non-preferred name); (1R,5S,6R,7S,9S,11S,12S,13S,14R)-3-amino-5,9,12,13,14-pentahydroxy-14-(hydroxymethyl)-8,10-dioxa-2-aza-4-azoniatetracyclo[7.3.1.1~7,11~.0~1,6~]tetradec-3-ene (non-preferred name); (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 (non-preferred name)
Molecular Formula C11H17N3O8
Molecular Weight 319.268
InChI InChI=1/C11H17N3O8/c12-8-13-6(17)2-4-9(19,1-15)5-3(16)10(2,14-8)7(18)11(20,21-4)22-5/h2-7,15-20H,1H2,(H3,12,13,14)/t2-,3-,4-,5+,6-,7+,9+,10-,11+/m1/s1
EINECS 224-458-8
Molecular Structure 4368-28-9 Tetrodotoxin
Density 2.78g/cm3
Boiling point 772.1°C at 760 mmHg
Refractive index 2.087
Flash point 420.7°C
Vapour Pressur 1.58E-27mmHg at 25°C
Hazard Symbols
Risk Codes
Safety Description
MSDS Material Safety Data Sheet