이름: 5-fluoro-3-[4-(2-methyl-1,3-dioxolan-2-yl)phenylthio]bromobenzene
SMILES:
CC1(c2ccc(Sc3cc(F)cc(Br)c3)cc2)OCCO1Molecular Processing
Molecular formula
C16H14BrFO2S
Molecular weight
369.26
Exact mass
367.9882
XLogP
4.96
TPSA
18.46
H-bond donors
0
H-bond acceptors
3
Rotatable bonds
3
Heavy atoms
21
Rings
3
Aromatic rings
2
Saturated rings
1
Aliphatic rings
1
Stereo centers
0
Undefined stereo
0
Formal charge
0
Heteroatoms
5
Covalent units
1
Fraction Csp3
0.25
Molar refractivity
83.92
Supplementary Information
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