Name: (S)-Benzyl 2-amino-4-(difluoromethoxy)butanoate
SMILES:
N[C@@H](CCOC(F)F)C(=O)OCc1ccccc1Molecular Processing
Molecular formula
C12H15F2NO3
Molecular weight
259.25
Exact mass
259.102
XLogP
1.69
TPSA
61.55
H-bond donors
1
H-bond acceptors
4
Rotatable bonds
7
Heavy atoms
18
Rings
1
Aromatic rings
1
Saturated rings
0
Aliphatic rings
0
Stereo centers
1
Undefined stereo
0
Formal charge
0
Heteroatoms
6
Covalent units
1
Fraction Csp3
0.417
Molar refractivity
60.79
Supplementary Information
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