Tetrabutylammonium triiodide
Catalog Number
ACM13311450-2
CAS
13311-45-0
IUPAC Name
tetrabutylazanium;triiodide;
Synonyms
Tetra-n-butylammonium triiodide
Molecular Weight
623.18
Molecular Formula
C16H36I3N
Product Information
Description
Description Packaging 5 g in glass bottle
Canonical SMILES
CCCC[N+](CCCC)(CCCC)CCCC.I[I-]I;
Inchi
InChI=1S/C16H36N.I3/c1-5-9-13-17(14-10-6-2,15-11-7-3)16-12-8-4;1-3-2/h5-16H2,1-4H3;/q+1;-1
InChIKey
SBSSZSCMFDYICE-UHFFFAOYSA-N
Melting Point
71 °C
Flash Point
Not applicable
Purity
>96.0%(T)
Appearance
Gray to Dark purple to Black powder to crystal
storage
Store under inert gas
Complexity
116
Condition To Avoid
Light Sensitive
Hazard Statements
H315 : Causes skin irritation.H319 : Causes serious eye irritation.
Heavy Atom Count
20
MDL Number
MFCD00059123
Precautionary Statements
P264 : Wash skin thoroughly after handling.P280 : Wear protective gloves/ eye protection/ face protection.P337 + P313 : If eye irritation persists: Get medical advice/ attention.P305 + P351 + P338 : IF IN EYES: Rinse cautiously with water for several minutes. Remove contact lenses, if present and easy to do. Continue rinsing.P302 + P352 : IF ON SKIN: Wash with plenty of soap and water.P332 + P313 : If skin irritation occurs: Get medical advice/ attention.P362 : Take off contaminated clothing and wash before reuse.
Reaxys Registry Number
3578617
Refractive Index
n20/D 1.439
Rotatable Bond Count
12
Signal Word
Warning
Solubility In Water
acetonitrile: 0.1 g/mL, clear, colorless
Monoisotopic Mass
622.998g/mol
Topological Polar Surface Area
0A^2
Exact Mass
622.998g/mol
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