C[C@]12C[C@H](F)[C@H]3[C@@H]([C@H](CCCCCCCl)CC4=CC(=O)CC[C@@H]43)[C@@H]1CCC2=O
Nombre: 7α-(6-chlorohexyl)-11β-fluoro-estr-4-ene-3,17-dione
SMILES: C[C@]12C[C@H](F)[C@H]3[C@@H]([C@H](CCCCCCCl)CC4=CC(=O)CC[C@@H]43)[C@@H]1CCC2=O

Molecular Processing

Molecular formula
C24H34ClFO2
Molecular weight
408.99
Exact mass
408.2231
XLogP
6.06
TPSA
34.14
H-bond donors
0
H-bond acceptors
2
Rotatable bonds
6
Heavy atoms
28
Rings
4
Aromatic rings
0
Saturated rings
3
Aliphatic rings
4
Stereo centers
7
Undefined stereo
0
Formal charge
0
Heteroatoms
4
Covalent units
1
Fraction Csp3
0.833
Molar refractivity
110.06

Supplementary Information

Obteniendo detalles…

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