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Home > Nitro Compounds > 101478-16-4
101478-16-4 | 1,8-Naphthyridine, 2-ethoxy-3,6-dinitro-
CAS No: 101478-16-4 Catalog No: AG0004KS MDL No:
Product Description
Catalog Number:
AG0004KS
Chemical Name:
1,8-Naphthyridine, 2-ethoxy-3,6-dinitro-
CAS Number:
101478-16-4
Molecular Formula:
C10H8N4O5
Molecular Weight:
264.1943
IUPAC Name:
2-ethoxy-3,6-dinitro-1,8-naphthyridine
InChI:
InChI=1S/C10H8N4O5/c1-2-19-10-8(14(17)18)4-6-3-7(13(15)16)5-11-9(6)12-10/h3-5H,2H2,1H3
InChI Key:
VKXIBKNBRAWLGF-UHFFFAOYSA-N
SMILES:
CCOc1nc2ncc(cc2cc1[N+](=O)[O-])[N+](=O)[O-]
Properties
Complexity:
355
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
264.049g/mol
Formal Charge:
0
Heavy Atom Count:
19
Hydrogen Bond Acceptor Count:
7
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
264.197g/mol
Monoisotopic Mass:
264.049g/mol
Rotatable Bond Count:
2
Topological Polar Surface Area:
127A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
1.8
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