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Home > Nitro Compounds > 87992-34-5
87992-34-5 | 1,6-Naphthyridine, 2-ethoxy-3-nitro-
CAS No: 87992-34-5 Catalog No: AG004L5X MDL No:
Product Description
Catalog Number:
AG004L5X
Chemical Name:
1,6-Naphthyridine, 2-ethoxy-3-nitro-
CAS Number:
87992-34-5
Molecular Formula:
C10H9N3O3
Molecular Weight:
219.1968
IUPAC Name:
2-ethoxy-3-nitro-1,6-naphthyridine
InChI:
InChI=1S/C10H9N3O3/c1-2-16-10-9(13(14)15)5-7-6-11-4-3-8(7)12-10/h3-6H,2H2,1H3
InChI Key:
QLRGKQDOFYJFRV-UHFFFAOYSA-N
SMILES:
CCOc1nc2ccncc2cc1[N+](=O)[O-]
Properties
Complexity:
256
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
219.064g/mol
Formal Charge:
0
Heavy Atom Count:
16
Hydrogen Bond Acceptor Count:
5
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
219.2g/mol
Monoisotopic Mass:
219.064g/mol
Rotatable Bond Count:
2
Topological Polar Surface Area:
80.8A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
1.6
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