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Tetrabutylammonium Thiocyanate

Catalog Number
ACM3674542
CAS Number
3674-54-2
Product Name
Tetrabutylammonium Thiocyanate
Structure
Category
Electronic Materials; Molecular Conductors
Synonyms
Tetrabutylammonium Rhodanide
IUPAC Name
tetrabutylazanium;thiocyanate;
Molecular Weight
300.55
Molecular Formula
C17H36N2S
Canonical SMILES
CCCC[N+](CCCC)(CCCC)CCCC.C(#N)[S-];
InChI
InChI=1S/C16H36N.CHNS/c1-5-9-13-17(14-10-6-2,15-11-7-3)16-12-8-4;2-1-3/h5-16H2,1-4H3;3H/q+1;/p-1
InChI Key
RSHBFZCIFFBTEW-UHFFFAOYSA-M
Melting Point
123 °C
Purity
>97.0%(T)
Solubility
soluble in Methanol
Appearance
White to Light yellow powder to crystal
Storage
Store under inert gas
Complexity
147
Covalently-Bonded Unit Count
2
EC Number
222-943-9
Exact Mass
300.26g/mol
Hazard Statements
H315 : Causes skin irritation.H319 : Causes serious eye irritation.
Heavy Atom Count
20
MDL Number
MFCD00012140
Monoisotopic Mass
300.26g/mol
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.
Rotatable Bond Count
12
Signal Word
Warning
Topological Polar Surface Area
24.8A^2
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