الاسم: 11-cyanoundecanoic acid
SMILES:
N#CCCCCCCCCCCC(=O)OMolecular Processing
Molecular formula
C12H21NO2
Molecular weight
211.3
Exact mass
211.1572
XLogP
3.5
TPSA
61.09
H-bond donors
1
H-bond acceptors
2
Rotatable bonds
10
Heavy atoms
15
Rings
0
Aromatic rings
0
Saturated rings
0
Aliphatic rings
0
Stereo centers
0
Undefined stereo
0
Formal charge
0
Heteroatoms
3
Covalent units
1
Fraction Csp3
0.833
Molar refractivity
59.42
Supplementary Information
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