이름: (2S, 4R)-1-N-Dodecyl-4-hydroxypyrrolidine-2-carboxylic acid, methyl ester
SMILES:
CCCCCCCCCCCCN1C[C@H](O)C[C@H]1C(=O)OCMolecular Processing
Molecular formula
C18H35NO3
Molecular weight
313.48
Exact mass
313.2617
XLogP
3.52
TPSA
49.77
H-bond donors
1
H-bond acceptors
4
Rotatable bonds
12
Heavy atoms
22
Rings
1
Aromatic rings
0
Saturated rings
1
Aliphatic rings
1
Stereo centers
2
Undefined stereo
0
Formal charge
0
Heteroatoms
4
Covalent units
1
Fraction Csp3
0.944
Molar refractivity
89.84
Supplementary Information
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