이름: 1-fluoro-4-methoxy-5-methyl-2-nitrobenzene
SMILES:
COc1cc([N+](=O)[O-])c(F)cc1CMolecular Processing
Molecular formula
C8H8FNO3
Molecular weight
185.15
Exact mass
185.0488
XLogP
2.05
TPSA
52.37
H-bond donors
0
H-bond acceptors
3
Rotatable bonds
2
Heavy atoms
13
Rings
1
Aromatic rings
1
Saturated rings
0
Aliphatic rings
0
Stereo centers
0
Undefined stereo
0
Formal charge
0
Heteroatoms
5
Covalent units
1
Fraction Csp3
0.25
Molar refractivity
44.34
Supplementary Information
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