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Substance Name: Silicon, (3,3,4,4,5,5,6,6,7,7,8,8-dodecafluoro-1-iodooctyl)((2,2'2,''-nitrilotris(ethanolato))(3-)-N,O,O',O'')-, (TB-5-23)-
RN: 135798-16-2
InChIKey: QFSNAWIJQIHQTM-UHFFFAOYSA-N

Classification Code

  • Drug / Therapeutic Agent

Molecular Formula

  • C14-H16-F12-I-N-O3-Si

Molecular Weight

  • 629.2464
 
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Names and Synonyms

  • Silicon, (3,3,4,4,5,5,6,6,7,7,8,8-dodecafluoro-1-iodooctyl)((2,2'2,''-nitrilotris(ethanolato))(3-)-N,O,O',O'')-, (TB-5-23)-

Registry Numbers

CAS Registry Number

  • 135798-16-2

System Generated Number

  • 0135798162

Structure Descriptors

InChI

1S/C8H4F12I.C6H12NO3.Si/c9-3(10)5(13,14)7(17,18)8(19,20)6(15,16)4(11,12)1-2-21;8-4-1-7(2-5-9)3-6-10;/h2-3H,1H2;1-6H2;/q-1;-3;+4

InChIKey

QFSNAWIJQIHQTM-UHFFFAOYSA-N

Smiles

C(C[O-])N(CC[O-])CC[O-].C([CH-]I)C(C(C(C(C(C(F)F)(F)F)(F)F)(F)F)(F)F)(F)F.[Si+4]

Toxicity

Organism Test Type Route Reported Dose (Normalized Dose) Effect Source
mouse LD50 intraperitoneal 3gm/kg (3000mg/kg)   Pharmaceutical Chemistry Journal Vol. 25, Pg. 405, 1991.