Nom: 2-chloro-1-(3-ethoxy-4-nitrophenoxy)-4-(trifiuoromethyl)benzene
SMILES:
CCOc1cc(Oc2ccc(C(F)(F)F)cc2Cl)ccc1[N+](=O)[O-]Molecular Processing
Molecular formula
C15H11ClF3NO4
Molecular weight
361.7
Exact mass
361.0329
XLogP
5.46
TPSA
61.6
H-bond donors
0
H-bond acceptors
4
Rotatable bonds
5
Heavy atoms
24
Rings
2
Aromatic rings
2
Saturated rings
0
Aliphatic rings
0
Stereo centers
0
Undefined stereo
0
Formal charge
0
Heteroatoms
9
Covalent units
1
Fraction Csp3
0.2
Molar refractivity
80.79
Supplementary Information
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