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1366050-42-1 | 1,5-Naphthyridin-4-ol, 6-chloro-3-nitro-
CAS No: 1366050-42-1 Catalog No: AG00124Z MDL No:
Product Description
Catalog Number:
AG00124Z
Chemical Name:
1,5-Naphthyridin-4-ol, 6-chloro-3-nitro-
CAS Number:
1366050-42-1
Molecular Formula:
C8H4ClN3O3
Molecular Weight:
225.5887
IUPAC Name:
6-chloro-3-nitro-1H-1,5-naphthyridin-4-one
InChI:
InChI=1S/C8H4ClN3O3/c9-6-2-1-4-7(11-6)8(13)5(3-10-4)12(14)15/h1-3H,(H,10,13)
InChI Key:
FURSTBLOQYSOEM-UHFFFAOYSA-N
SMILES:
Clc1ccc2c(n1)c(O)c(cn2)[N+](=O)[O-]
Properties
Complexity:
339
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
224.994g/mol
Formal Charge:
0
Heavy Atom Count:
15
Hydrogen Bond Acceptor Count:
5
Hydrogen Bond Donor Count:
1
Isotope Atom Count:
0
Molecular Weight:
225.588g/mol
Monoisotopic Mass:
224.994g/mol
Rotatable Bond Count:
0
Topological Polar Surface Area:
87.8A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
1.8
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