CC(C)(C)OC(=O)N[C@H](C=O)Cc1ccccc1
Name: (2S)-2-(tert-butoxycarbonyl)amino-3-phenylpropanal
SMILES: CC(C)(C)OC(=O)N[C@H](C=O)Cc1ccccc1

Molecular Processing

Molecular formula
C14H19NO3
Molecular weight
249.31
Exact mass
249.1365
XLogP
2.32
TPSA
55.4
H-bond donors
1
H-bond acceptors
3
Rotatable bonds
4
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
0.429
Molar refractivity
69.37

Supplementary Information

Details werden geladen…

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