Name: 2-tert-butoxycarbonylamino-pentanedioic acid 1-benzyl ester
SMILES:
CC(C)(C)OC(=O)NC(CCC(=O)O)C(=O)OCc1ccccc1Molecular Processing
Molecular formula
C17H23NO6
Molecular weight
337.37
Exact mass
337.1525
XLogP
2.49
TPSA
101.93
H-bond donors
2
H-bond acceptors
5
Rotatable bonds
7
Heavy atoms
24
Rings
1
Aromatic rings
1
Saturated rings
0
Aliphatic rings
0
Stereo centers
1
Undefined stereo
1
Formal charge
0
Heteroatoms
7
Covalent units
1
Fraction Csp3
0.471
Molar refractivity
86.27
Supplementary Information
Details werden geladen…
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