Name: ethyl 3-nitriloalaninate
SMILES:
CCOC(=O)[C@@H](N)C#NMolecular Processing
Molecular formula
C5H8N2O2
Molecular weight
128.13
Exact mass
128.0586
XLogP
-0.6
TPSA
76.11
H-bond donors
1
H-bond acceptors
4
Rotatable bonds
2
Heavy atoms
9
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
0.6
Molar refractivity
30.22
Supplementary Information
Details werden geladen…
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