Name: (S)-3-carbamoyl-2-phenyl propanol acetate
SMILES:
CC(=O)OC[C@@H](CC(N)=O)c1ccccc1Molecular Processing
Molecular formula
C12H15NO3
Molecular weight
221.26
Exact mass
221.1052
XLogP
1.21
TPSA
69.39
H-bond donors
1
H-bond acceptors
3
Rotatable bonds
5
Heavy atoms
16
Rings
1
Aromatic rings
1
Saturated rings
0
Aliphatic rings
0
Stereo centers
1
Undefined stereo
0
Formal charge
0
Heteroatoms
4
Covalent units
1
Fraction Csp3
0.333
Molar refractivity
59.63
Supplementary Information
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