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Chemical structure of 4-acetoxy TMT (iodide)

GC52232

4-acetoxy TMT (iodide)

Also known as 2-(4-acetyloxy-1H-indol-3-yl)ethyl-trimethylazanium iodide

An Analytical Reference Standard

ChemicalCAS2451455-98-2MW388.2FormulaC15H21N2O2 ? I
CAS number
2451455-98-2
Molecular weight
388.2
Formula
C15H21N2O2 ? I
Solubility
DMF: 5 mg/ml,DMSO: 5 mg/ml,PBS (pH 7·2): 2 mg/ml
InChIKey
MTXCVVIYLGOXRG-UHFFFAOYSA-M
Catalogue number
GC52232
Brand
GLPBIO
Computed properties PubChem CID 168325142 · TPSA 42.1 Ų · H-bond donors 1 · H-bond acceptors 3
TPSA
42.1 Ų
H-bond donors
1
H-bond acceptors
3
Rotatable bonds
5
Heavy atoms
20

SMILES CC(=O)OC1=CC=CC2=C1C(=CN2)CC[N+](C)(C)C.[I-]

Computed descriptors from PubChem (CID 168325142), public domain. Identity cross-checked against the supplier's molecular formula and weight — verify before use.

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