Nom: 3-Carboxythianthrene-5,5,10-trioxide
SMILES:
O=C(O)c1ccc2c(c1)S(=O)(=O)c1ccccc1S2=OMolecular Processing
Molecular formula
C13H8O5S2
Molecular weight
308.34
Exact mass
307.9813
XLogP
1.7
TPSA
88.51
H-bond donors
1
H-bond acceptors
4
Rotatable bonds
1
Heavy atoms
20
Rings
3
Aromatic rings
2
Saturated rings
0
Aliphatic rings
1
Stereo centers
1
Undefined stereo
1
Formal charge
0
Heteroatoms
7
Covalent units
1
Fraction Csp3
0
Molar refractivity
69.97
Supplementary Information
Récupération des détails…
Impliqué dans 2 réactions→