CC(C)[C@H](N)C(=O)OCc1ccccc1
Name: L-Valine benzyl ester
SMILES: CC(C)[C@H](N)C(=O)OCc1ccccc1

Molecular Processing

Molecular formula
C12H17NO2
Molecular weight
207.27
Exact mass
207.1259
XLogP
1.71
TPSA
52.32
H-bond donors
1
H-bond acceptors
3
Rotatable bonds
4
Heavy atoms
15
Rings
1
Aromatic rings
1
Saturated rings
0
Aliphatic rings
0
Stereo centers
1
Undefined stereo
0
Formal charge
0
Heteroatoms
3
Covalent units
1
Fraction Csp3
0.417
Molar refractivity
59.05

Supplementary Information

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