Name: 5-decylaminoisophthalic acid disodium salt
SMILES:
CCCCCCCCCCNc1cc(C(=O)[O-])cc(C(=O)[O-])c1.[Na+].[Na+]Molecular Processing
Molecular formula
C18H25NNa2O4
Molecular weight
365.38
Exact mass
365.1579
XLogP
-4.03
TPSA
92.29
H-bond donors
1
H-bond acceptors
5
Rotatable bonds
12
Heavy atoms
25
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
0.556
Molar refractivity
86.2
Supplementary Information
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