이름: 2-(4-penten-1-yl)-4-(trifluoromethyl)pyrimidine
SMILES:
C=CCCCc1nccc(C(F)(F)F)n1Molecular Processing
Molecular formula
C10H11F3N2
Molecular weight
216.21
Exact mass
216.0874
XLogP
3
TPSA
25.78
H-bond donors
0
H-bond acceptors
2
Rotatable bonds
4
Heavy atoms
15
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
0.4
Molar refractivity
50.17
Supplementary Information
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