Name: 2,3-difluoro-4-heptyloxybenzoic acid
SMILES:
CCCCCCCOc1ccc(C(=O)O)c(F)c1FMolecular Processing
Molecular formula
C14H18F2O3
Molecular weight
272.29
Exact mass
272.1224
XLogP
4.01
TPSA
46.53
H-bond donors
1
H-bond acceptors
2
Rotatable bonds
8
Heavy atoms
19
Rings
1
Aromatic rings
1
Saturated rings
0
Aliphatic rings
0
Stereo centers
0
Undefined stereo
0
Formal charge
0
Heteroatoms
5
Covalent units
1
Fraction Csp3
0.5
Molar refractivity
67.57
Supplementary Information
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