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Home > Nitro Compounds > 1408075-65-9
1408075-65-9 | 3-Nitro-1,6-naphthyridin-5(6H)-one
CAS No: 1408075-65-9 Catalog No: AG00HVXF MDL No:MFCD23106139
Product Description
Catalog Number:
AG00HVXF
Chemical Name:
3-Nitro-1,6-naphthyridin-5(6H)-one
CAS Number:
1408075-65-9
Molecular Formula:
C8H5N3O3
Molecular Weight:
191.1436
MDL Number:
MFCD23106139
IUPAC Name:
3-nitro-6H-1,6-naphthyridin-5-one
InChI:
InChI=1S/C8H5N3O3/c12-8-6-3-5(11(13)14)4-10-7(6)1-2-9-8/h1-4H,(H,9,12)
InChI Key:
MLPJIQYHSLWMLH-UHFFFAOYSA-N
SMILES:
[O-][N+](=O)c1cnc2c(c1)c(=O)[nH]cc2
Properties
Complexity:
297
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
191.033g/mol
Formal Charge:
0
Heavy Atom Count:
14
Hydrogen Bond Acceptor Count:
4
Hydrogen Bond Donor Count:
1
Isotope Atom Count:
0
Molecular Weight:
191.146g/mol
Monoisotopic Mass:
191.033g/mol
Rotatable Bond Count:
0
Topological Polar Surface Area:
87.8A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
0.1
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