C[C@H](O)c1c(Cl)ccc(F)c1Cl
Name: (S)-1-(2,6-dichloro-3-fluorophenyl)-ethanol
SMILES: C[C@H](O)c1c(Cl)ccc(F)c1Cl

Molecular Processing

Molecular formula
C8H7Cl2FO
Molecular weight
209.05
Exact mass
207.9858
XLogP
3.19
TPSA
20.23
H-bond donors
1
H-bond acceptors
1
Rotatable bonds
1
Heavy atoms
12
Rings
1
Aromatic rings
1
Saturated rings
0
Aliphatic rings
0
Stereo centers
1
Undefined stereo
0
Formal charge
0
Heteroatoms
4
Covalent units
1
Fraction Csp3
0.25
Molar refractivity
47.05

Supplementary Information

Details werden geladen…

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