이름: N-(p-nitrobenzyl)δ-aminovaleric acid
SMILES:
O=C(O)CCCCNCc1ccc([N+](=O)[O-])cc1Molecular Processing
Molecular formula
C12H16N2O4
Molecular weight
252.27
Exact mass
252.111
XLogP
1.94
TPSA
92.47
H-bond donors
2
H-bond acceptors
4
Rotatable bonds
8
Heavy atoms
18
Rings
1
Aromatic rings
1
Saturated rings
0
Aliphatic rings
0
Stereo centers
0
Undefined stereo
0
Formal charge
0
Heteroatoms
6
Covalent units
1
Fraction Csp3
0.417
Molar refractivity
66.29
Supplementary Information
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