Название: (2S)-2-ethoxy-3-(4-hydroxy-2,6-dimethyl-phenyl)-propionic acid methyl ester
SMILES:
CCO[C@@H](Cc1c(C)cc(O)cc1C)C(=O)OCMolecular Processing
Molecular formula
C14H20O4
Molecular weight
252.31
Exact mass
252.1362
XLogP
2.13
TPSA
55.76
H-bond donors
1
H-bond acceptors
4
Rotatable bonds
5
Heavy atoms
18
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
0.5
Molar refractivity
68.71
Supplementary Information
Загрузка подробностей…
Участвует в 18 реакциях→