名称: 6-bromo-4,4-dibutylthiochroman
SMILES:
CCCCC1(CCCC)CCSc2ccc(Br)cc21Molecular Processing
Molecular formula
C17H25BrS
Molecular weight
341.36
Exact mass
340.086
XLogP
6.56
TPSA
0
H-bond donors
0
H-bond acceptors
1
Rotatable bonds
6
Heavy atoms
19
Rings
2
Aromatic rings
1
Saturated rings
0
Aliphatic rings
1
Stereo centers
0
Undefined stereo
0
Formal charge
0
Heteroatoms
2
Covalent units
1
Fraction Csp3
0.647
Molar refractivity
90.21
Supplementary Information
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