이름: 4-methoxy-3-trifluoromethyl aniline
SMILES:
COc1ccc(N)cc1C(F)(F)FMolecular Processing
Molecular formula
C8H8F3NO
Molecular weight
191.15
Exact mass
191.0558
XLogP
2.3
TPSA
35.25
H-bond donors
1
H-bond acceptors
2
Rotatable bonds
1
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
42.41
Supplementary Information
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