이름: 3-bromo-2-thienyl-4-ethylphenylmethanol
SMILES:
CCc1ccc(C(O)c2sccc2Br)cc1Molecular Processing
Molecular formula
C13H13BrOS
Molecular weight
297.22
Exact mass
295.987
XLogP
4.15
TPSA
20.23
H-bond donors
1
H-bond acceptors
2
Rotatable bonds
3
Heavy atoms
16
Rings
2
Aromatic rings
2
Saturated rings
0
Aliphatic rings
0
Stereo centers
1
Undefined stereo
1
Formal charge
0
Heteroatoms
3
Covalent units
1
Fraction Csp3
0.231
Molar refractivity
71.9
Supplementary Information
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