Name: 1-methallyloxy-2-nitrobenzene
SMILES:
C=C(C)COc1ccccc1[N+](=O)[O-]Molecular Processing
Molecular formula
C10H11NO3
Molecular weight
193.2
Exact mass
193.0739
XLogP
2.55
TPSA
52.37
H-bond donors
0
H-bond acceptors
3
Rotatable bonds
4
Heavy atoms
14
Rings
1
Aromatic rings
1
Saturated rings
0
Aliphatic rings
0
Stereo centers
0
Undefined stereo
0
Formal charge
0
Heteroatoms
4
Covalent units
1
Fraction Csp3
0.2
Molar refractivity
53.41
Supplementary Information
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