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Tetraheptylammonium Iodide

Catalog Number
ACM3535839
CAS Number
3535-83-9
Product Name
Tetraheptylammonium Iodide
Structure
Category
Battery Materials; Dye-Sensitized Solar Cell (DSSC) Materials; Electronic Materials
Synonyms
ACMC-1AEUW; AKOS015833286; CTK8B1520; Tetraheptylammonium iodide, >=99.0% (AT); 3535-83-9; 1-Heptanaminium, N,N,N-triheptyl-, iodide (1:1); NSC 56441; I14-115314; NSC56441; AN-20233;
IUPAC Name
tetraheptylazanium;iodide;
Molecular Weight
537.70
Molecular Formula
C28H60IN
Canonical SMILES
CCCCCCC[N+](CCCCCCC)(CCCCCCC)CCCCCCC.[I-];
InChI
InChI=1S/C28H60N.HI/c1-5-9-13-17-21-25-29(26-22-18-14-10-6-2,27-23-19-15-11-7-3)28-24-20-16-12-8-4;/h5-28H2,1-4H3;1H/q+1;/p-1
InChI Key
KCSOHLKZTZMKQA-UHFFFAOYSA-M
Melting Point
123 °C
Purity
>98.0%T
Appearance
White to Almost white powder to crystal
Storage
Store under inert gas
Complexity
237
Covalently-Bonded Unit Count
2
EC Number
222-570-1
Exact Mass
537.377g/mol
Hazard Statements
H315 : Causes skin irritation.H319 : Causes serious eye irritation.
Heavy Atom Count
30
MDL Number
MFCD00041984
Monoisotopic Mass
537.377g/mol
NSC Number
56441
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.
Refractive Index
1.41
Rotatable Bond Count
24
Signal Word
Warning
Specific Gravity
1.40
Topological Polar Surface Area
0A^2
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