1,1,2,3-Tetramethyl-1H-benzo[e]indol-3-ium iodide

Name: 1,1,2,3-Tetramethyl-1H-benzo[e]indol-3-ium iodide
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CAS No. 58464-25-8
Cat. No. CS-0570869
Purity≥97%
MDL No.None

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1,1,2,3-Tetramethyl-1H-benzo[e]indol-3-ium iodide|CS-0570869

Structure of 58464-25-8

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Description

This tetramethyl-substituted benzo[e]indolium salt features a rigid, electron-deficient cationic core stabilized by iodide counterions. The steric bulk of the four methyl groups enhances solubility and reduces aggregation, while the extended π-system supports strong fluorescence and redox activity. Ideal for photoredox catalysis and organic electronics applications under standard bench conditions.

Application

1,1,2,3-Tetramethyl-1H-benzo[e]indol-3-ium iodide serves as a stable, bench-ready cationic building block for the construction of complex heterocyclic scaffolds. Its well-defined quaternary nitrogen center enables efficient functionalization in electrophilic substitution and cross-coupling reactions. The iodide counterion ensures good solubility and reactivity in polar solvents, facilitating downstream transformations. This compound functions as a key intermediate in the synthesis of biologically relevant indole-based architectures, offering predictable reactivity and ease of purification in synthetic workflows.

General Information

CAS No. 58464-25-8
Cat. No. CS-0570869
Purity ≥97%
MDL No. None
Storage RT, sealed storage, away from moisture and light
Shipping Room temperature in continental US; may vary elsewhere.
Molecular Formula C₁₆H₁₈IN
Molecular Weight 351.23
Synonym(s) N-buthy1-benzo-[C,D]-indole indide
SMILES CC1=[N+](C2=C(C1(C)C)C3=CC=CC=C3C=C2)C.[I-]

Computational Chemistry Data

TPSA 3.01
LogP 0.8697
H_Acceptors 0
H_Donors 0
Rotatable_Bonds 0

Safety Information

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GHS Pictogram :	GHS No : GHS07
Signal Word : Warning	UN#: N/A
Class : N/A	Packing Group : N/A
Hazard Statements : H315-H319
Precautionary Statements : P264-P280-P302+P352-P362+P364

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1,1,2,3-Tetramethyl-1H-benzo[e]indol-3-ium iodide

CAS No. 58464-25-8

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