N[C@@H](CO)Cc1ccoc1.O=C(O)C(F)(F)F
Name: (R)-2-amino-3-furan-3-yl-propan-1-ol trifluoroacetate
SMILES: N[C@@H](CO)Cc1ccoc1.O=C(O)C(F)(F)F

Molecular Processing

Molecular formula
C9H12F3NO4
Molecular weight
255.19
Exact mass
255.0718
XLogP
0.77
TPSA
96.69
H-bond donors
3
H-bond acceptors
4
Rotatable bonds
3
Heavy atoms
17
Rings
1
Aromatic rings
1
Saturated rings
0
Aliphatic rings
0
Stereo centers
1
Undefined stereo
0
Formal charge
0
Heteroatoms
8
Covalent units
2
Fraction Csp3
0.444
Molar refractivity
51.16

Supplementary Information

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