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Chemical structure of 2-Amino-3-methylimidazo[4,5-f]quinoline

GC40707

2-Amino-3-methylimidazo[4,5-f]quinoline

Also known as 3-methylimidazo[4,5-f]quinolin-2-amine

2-Amino-3-methylimidazo[4,5-f]quinoline (IQ) is a food-derived carcinogen that is found in high temperature-cooked meats and tobacco smoke

ChemicalCAS76180-96-6MW198.2FormulaC11H10N4
CAS number
76180-96-6
Molecular weight
198.2
Formula
C11H10N4
Solubility
DMF： 10 mg/ml,DMSO： 10 mg/ml,Ethanol： 15 mg/ml,Ethanol：PBS (pH 7·2) (1：3)： 0·25 mg/ml
InChIKey
ARZWATDYIYAUTA-UHFFFAOYSA-N
Catalogue number
GC40707
Brand
GLPBIO
Computed properties PubChem CID 53462 · XLogP 1.5 · TPSA 56.7 Ų · H-bond donors 1
XLogP
1.5
TPSA
56.7 Ų
H-bond donors
1
H-bond acceptors
3
Rotatable bonds
0
Heavy atoms
15

SMILES CN1C2=C(C3=C(C=C2)N=CC=C3)N=C1N

Computed descriptors from PubChem (CID 53462), public domain. Identity cross-checked against the supplier's molecular formula and weight — verify before use.

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