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87992-37-8 | 1,6-Naphthyridin-4-amine, 2-chloro-3-nitro-
CAS No: 87992-37-8 Catalog No: AG004L5V MDL No:
Product Description
Catalog Number:
AG004L5V
Chemical Name:
1,6-Naphthyridin-4-amine, 2-chloro-3-nitro-
CAS Number:
87992-37-8
Molecular Formula:
C8H5ClN4O2
Molecular Weight:
224.6039
IUPAC Name:
2-chloro-3-nitro-1,6-naphthyridin-4-amine
InChI:
InChI=1S/C8H5ClN4O2/c9-8-7(13(14)15)6(10)4-3-11-2-1-5(4)12-8/h1-3H,(H2,10,12)
InChI Key:
BYOTZHURNVFCRF-UHFFFAOYSA-N
SMILES:
[O-][N+](=O)c1c(Cl)nc2c(c1N)cncc2
Properties
Complexity:
260
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
224.01g/mol
Formal Charge:
0
Heavy Atom Count:
15
Hydrogen Bond Acceptor Count:
5
Hydrogen Bond Donor Count:
1
Isotope Atom Count:
0
Molecular Weight:
224.604g/mol
Monoisotopic Mass:
224.01g/mol
Rotatable Bond Count:
0
Topological Polar Surface Area:
97.6A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
1.8
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