Name: 5-nonylaminoisophthalic acid disodium salt
SMILES:
CCCCCCCCCNc1cc(C(=O)[O-])cc(C(=O)[O-])c1.[Na+].[Na+]Molecular Processing
Molecular formula
C17H23NNa2O4
Molecular weight
351.35
Exact mass
351.1422
XLogP
-4.42
TPSA
92.29
H-bond donors
1
H-bond acceptors
5
Rotatable bonds
11
Heavy atoms
24
Rings
1
Aromatic rings
1
Saturated rings
0
Aliphatic rings
0
Stereo centers
0
Undefined stereo
0
Formal charge
0
Heteroatoms
7
Covalent units
3
Fraction Csp3
0.529
Molar refractivity
81.59
Supplementary Information
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