Name: N-(1-cyano-1,2-dimethylpropyl)phthalamic acid
SMILES:
CC(C)C(C)(C#N)NC(=O)c1ccccc1C(=O)OMolecular Processing
Molecular formula
C14H16N2O3
Molecular weight
260.29
Exact mass
260.1161
XLogP
2.05
TPSA
90.19
H-bond donors
2
H-bond acceptors
3
Rotatable bonds
4
Heavy atoms
19
Rings
1
Aromatic rings
1
Saturated rings
0
Aliphatic rings
0
Stereo centers
1
Undefined stereo
1
Formal charge
0
Heteroatoms
5
Covalent units
1
Fraction Csp3
0.357
Molar refractivity
69.72
Supplementary Information
Details werden geladen…
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