Name: 1-(5-nitro-1-benzofuran-2-yl)ethanone
SMILES:
CC(=O)c1cc2cc([N+](=O)[O-])ccc2o1Molecular Processing
Molecular formula
C10H7NO4
Molecular weight
205.17
Exact mass
205.0375
XLogP
2.54
TPSA
73.35
H-bond donors
0
H-bond acceptors
4
Rotatable bonds
2
Heavy atoms
15
Rings
2
Aromatic rings
2
Saturated rings
0
Aliphatic rings
0
Stereo centers
0
Undefined stereo
0
Formal charge
0
Heteroatoms
5
Covalent units
1
Fraction Csp3
0.1
Molar refractivity
52.87
Supplementary Information
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