Name: N-(3-trifluoromethylphenyl)thiourea
SMILES:
NC(=S)Nc1cccc(C(F)(F)F)c1Molecular Processing
Molecular formula
C8H7F3N2S
Molecular weight
220.22
Exact mass
220.0282
XLogP
2.36
TPSA
38.05
H-bond donors
2
H-bond acceptors
1
Rotatable bonds
1
Heavy atoms
14
Rings
1
Aromatic rings
1
Saturated rings
0
Aliphatic rings
0
Stereo centers
0
Undefined stereo
0
Formal charge
0
Heteroatoms
6
Covalent units
1
Fraction Csp3
0.125
Molar refractivity
51.85
Supplementary Information
Details werden geladen…
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