이름: (5-[1,3]dioxolane-2-ylthiophen-2-yl)-(5-methyl-thiophen-2-yl)-methanol
SMILES:
Cc1ccc(C(O)c2ccc(C3OCCO3)s2)s1Molecular Processing
Molecular formula
C13H14O3S2
Molecular weight
282.39
Exact mass
282.0384
XLogP
3.25
TPSA
38.69
H-bond donors
1
H-bond acceptors
5
Rotatable bonds
3
Heavy atoms
18
Rings
3
Aromatic rings
2
Saturated rings
1
Aliphatic rings
1
Stereo centers
1
Undefined stereo
1
Formal charge
0
Heteroatoms
5
Covalent units
1
Fraction Csp3
0.385
Molar refractivity
72.08
Supplementary Information
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