Cc1ccc(S(=O)(=O)O[C@H]2CO[C@H]3[C@@H]2OC[C@@H]3Br)cc1
Nombre: bromotosylate
SMILES: Cc1ccc(S(=O)(=O)O[C@H]2CO[C@H]3[C@@H]2OC[C@@H]3Br)cc1

Molecular Processing

Molecular formula
C13H15BrO5S
Molecular weight
363.23
Exact mass
361.9824
XLogP
1.63
TPSA
61.83
H-bond donors
0
H-bond acceptors
5
Rotatable bonds
3
Heavy atoms
20
Rings
3
Aromatic rings
1
Saturated rings
2
Aliphatic rings
2
Stereo centers
4
Undefined stereo
0
Formal charge
0
Heteroatoms
7
Covalent units
1
Fraction Csp3
0.538
Molar refractivity
75.43

Supplementary Information

Obteniendo detalles…

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