Nombre: 1,4-dihydro-2,3-benzoxathiin 3-oxide
SMILES:
O=S1Cc2ccccc2CO1Molecular Processing
Molecular formula
C8H8O2S
Molecular weight
168.22
Exact mass
168.0245
XLogP
1.38
TPSA
26.3
H-bond donors
0
H-bond acceptors
2
Rotatable bonds
0
Heavy atoms
11
Rings
2
Aromatic rings
1
Saturated rings
0
Aliphatic rings
1
Stereo centers
1
Undefined stereo
1
Formal charge
0
Heteroatoms
3
Covalent units
1
Fraction Csp3
0.25
Molar refractivity
43.08
Supplementary Information
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