COc1c(F)cnc(CCl)c1C
SMILES: COc1c(F)cnc(CCl)c1C

Molecular Processing

Molecular formula
C8H9ClFNO
Molecular weight
189.62
Exact mass
189.0357
XLogP
2.28
TPSA
22.12
H-bond donors
0
H-bond acceptors
2
Rotatable bonds
2
Heavy atoms
12
Rings
1
Aromatic rings
1
Saturated rings
0
Aliphatic rings
0
Stereo centers
0
Undefined stereo
0
Formal charge
0
Heteroatoms
4
Covalent units
1
Fraction Csp3
0.375
Molar refractivity
45.04

Supplementary Information

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