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Home > Nitro Compounds > 85-81-4
85-81-4 | 6-Methoxy-8-nitroquinoline
CAS No: 85-81-4 Catalog No: AG003N9Q MDL No:MFCD00006802
Product Description
Catalog Number:
AG003N9Q
Chemical Name:
6-Methoxy-8-nitroquinoline
CAS Number:
85-81-4
Molecular Formula:
C10H8N2O3
Molecular Weight:
204.1821
MDL Number:
MFCD00006802
IUPAC Name:
6-methoxy-8-nitroquinoline
InChI:
InChI=1S/C10H8N2O3/c1-15-8-5-7-3-2-4-11-10(7)9(6-8)12(13)14/h2-6H,1H3
InChI Key:
MIMUSZHMZBJBPO-UHFFFAOYSA-N
SMILES:
COc1cc2cccnc2c(c1)[N+](=O)[O-]
EC Number:
201-633-7
UNII:
ATS412O1XO
NSC Number:
1883
Properties
Complexity:
241
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
204.053g/mol
Formal Charge:
0
Heavy Atom Count:
15
Hydrogen Bond Acceptor Count:
4
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
204.185g/mol
Monoisotopic Mass:
204.053g/mol
Rotatable Bond Count:
1
Topological Polar Surface Area:
67.9A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
1.9
Literature
| Title | Journal |
|---|---|
| Synthesis, antimalarial, antileishmanial, antimicrobial, cytotoxicity, and methemoglobin (MetHB) formation activities of new 8-quinolinamines. | Bioorganic & medicinal chemistry 20070115 |
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