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Home > Imidazoles > 115397-29-0
115397-29-0 | 3H-Imidazo[4,5-f]quinoline, 2-azido-3-methyl-
CAS No: 115397-29-0 Catalog No: AG000FXP MDL No:
Product Description
Catalog Number:
AG000FXP
Chemical Name:
3H-Imidazo[4,5-f]quinoline, 2-azido-3-methyl-
CAS Number:
115397-29-0
Molecular Formula:
C11H8N6
Molecular Weight:
224.2214
IUPAC Name:
2-azido-3-methylimidazo[4,5-f]quinoline
InChI:
InChI=1S/C11H8N6/c1-17-9-5-4-8-7(3-2-6-13-8)10(9)14-11(17)15-16-12/h2-6H,1H3
InChI Key:
DYMXFVKLXKRJTM-UHFFFAOYSA-N
SMILES:
[N-]=[N+]=Nc1nc2c(n1C)ccc1c2cccn1
Properties
Complexity:
339
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
224.081g/mol
Formal Charge:
0
Heavy Atom Count:
17
Hydrogen Bond Acceptor Count:
4
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
224.227g/mol
Monoisotopic Mass:
224.081g/mol
Rotatable Bond Count:
1
Topological Polar Surface Area:
45.1A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
1
XLogP3:
3.1
Literature
| Title | Journal |
|---|---|
| Hemin potentiates nitric oxide-mediated nitrosation of 2-amino-3-methylimidazo[4,5-f]quinoline (IQ) to 2-nitrosoamino-3-methylimidazo[4,5-f]quinoline. | Chemical research in toxicology 20050301 |
| 2-Nitrosoamino-3-methylimidazo[4,5-f]quinoline stability and reactivity. | Chemical research in toxicology 20040501 |
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