Nombre: 9-methoxy phenanthrene-1,2-dicarboxylic acid dimethyl ester
SMILES:
COC(=O)c1ccc2c(cc(OC)c3ccccc32)c1C(=O)OCMolecular Processing
Molecular formula
C19H16O5
Molecular weight
324.33
Exact mass
324.0998
XLogP
3.57
TPSA
61.83
H-bond donors
0
H-bond acceptors
5
Rotatable bonds
3
Heavy atoms
24
Rings
3
Aromatic rings
3
Saturated rings
0
Aliphatic rings
0
Stereo centers
0
Undefined stereo
0
Formal charge
0
Heteroatoms
5
Covalent units
1
Fraction Csp3
0.158
Molar refractivity
90.69
Supplementary Information
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