COc1c(C)cc(F)cc1C(C)N
Name: 1-(5-Fluoro-2-methoxy-3-methylphenyl)ethanamine
SMILES: COc1c(C)cc(F)cc1C(C)N

Molecular Processing

Molecular formula
C10H14FNO
Molecular weight
183.23
Exact mass
183.1059
XLogP
2.16
TPSA
35.25
H-bond donors
1
H-bond acceptors
2
Rotatable bonds
2
Heavy atoms
13
Rings
1
Aromatic rings
1
Saturated rings
0
Aliphatic rings
0
Stereo centers
1
Undefined stereo
1
Formal charge
0
Heteroatoms
3
Covalent units
1
Fraction Csp3
0.4
Molar refractivity
50.29

Supplementary Information

Details werden geladen…

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