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Chemical structure of 25I-Nboh hydrochloride

GC42105

25I-Nboh hydrochloride

Also listed as 25I-NBOH (hydrochloride)

25I-NBOH is a derivative of the phenethylamine hallucinogen 2C-I with an N-(2-hydroxybenzyl) addition at the amine

ChemicalCAS1539266-12-0MW449.7FormulaC17H20INO3•HCl
CAS number
1539266-12-0
Molecular weight
449.7
Formula
C17H20INO3•HCl
Solubility
DMF: 30 mg/ml,DMF:PBS (pH 7) (1:10): 0·5 mg/ml,DMSO: 30 mg/ml,Ethanol: 20 mg/ml
InChIKey
PXODWOUSZUTKOZ-UHFFFAOYSA-N
Catalogue number
GC42105
Brand
GLPBIO
Computed properties PubChem CID 137699643 · TPSA 50.7 Ų · H-bond donors 3 · H-bond acceptors 4
TPSA
50.7 Ų
H-bond donors
3
H-bond acceptors
4
Rotatable bonds
7
Heavy atoms
23

SMILES COC1=CC(=C(C=C1CCNCC2=CC=CC=C2O)OC)I.Cl

Computed descriptors from PubChem (CID 137699643), public domain. Identity cross-checked against the supplier's molecular formula and weight — verify before use.

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