Name: methyl 2-(difluoromethoxy)-3-fluorobenzoate
SMILES:
COC(=O)c1cccc(F)c1OC(F)FMolecular Processing
Molecular formula
C9H7F3O3
Molecular weight
220.15
Exact mass
220.0347
XLogP
2.21
TPSA
35.53
H-bond donors
0
H-bond acceptors
3
Rotatable bonds
3
Heavy atoms
15
Rings
1
Aromatic rings
1
Saturated rings
0
Aliphatic rings
0
Stereo centers
0
Undefined stereo
0
Formal charge
0
Heteroatoms
6
Covalent units
1
Fraction Csp3
0.222
Molar refractivity
44.37
Supplementary Information
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