Nom: Ethyl 1,4-diethoxy-2,3-naphthalenedicarboxylate
SMILES:
CCOC(=O)c1c(C(=O)[O-])c(OCC)c2ccccc2c1OCCMolecular Processing
Molecular formula
C18H19O6-
Molecular weight
331.34
Exact mass
331.1187
XLogP
2.18
TPSA
84.89
H-bond donors
0
H-bond acceptors
6
Rotatable bonds
7
Heavy atoms
24
Rings
2
Aromatic rings
2
Saturated rings
0
Aliphatic rings
0
Stereo centers
0
Undefined stereo
0
Formal charge
-1
Heteroatoms
6
Covalent units
1
Fraction Csp3
0.333
Molar refractivity
86.57
Supplementary Information
Récupération des détails…
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