Название: (3R,4R)-1-benzyl-4-methoxypyrrolidin-3-ol
SMILES:
CO[C@@H]1CN(Cc2ccccc2)C[C@H]1OMolecular Processing
Molecular formula
C12H17NO2
Molecular weight
207.27
Exact mass
207.1259
XLogP
0.88
TPSA
32.7
H-bond donors
1
H-bond acceptors
3
Rotatable bonds
3
Heavy atoms
15
Rings
2
Aromatic rings
1
Saturated rings
1
Aliphatic rings
1
Stereo centers
2
Undefined stereo
0
Formal charge
0
Heteroatoms
3
Covalent units
1
Fraction Csp3
0.5
Molar refractivity
58.52
Supplementary Information
InChIKey: ZZBLMCUYQQVQEW-VXGBXAGGSA-N
Синонимы
SCHEMBL6212846ZZBLMCUYQQVQEW-VXGBXAGGSA-Ntrans-1-Benzyl-3-hydroxy-4-methoxypyrrolidine
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