Name: (R)4-cyano-3-hydroxy butyric acid ethyl ester
SMILES:
CCOC(=O)C[C@H](O)CC#NMolecular Processing
Molecular formula
C7H11NO3
Molecular weight
157.17
Exact mass
157.0739
XLogP
0.21
TPSA
70.32
H-bond donors
1
H-bond acceptors
4
Rotatable bonds
4
Heavy atoms
11
Rings
0
Aromatic rings
0
Saturated rings
0
Aliphatic rings
0
Stereo centers
1
Undefined stereo
0
Formal charge
0
Heteroatoms
4
Covalent units
1
Fraction Csp3
0.714
Molar refractivity
37.49
Supplementary Information
Details werden geladen…
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