Название: 5,7-dihydroxy-4-propyl-coumarin
SMILES:
CCCc1cc(=O)oc2cc(O)cc(O)c12Molecular Processing
Molecular formula
C12H12O4
Molecular weight
220.22
Exact mass
220.0736
XLogP
2.16
TPSA
70.67
H-bond donors
2
H-bond acceptors
4
Rotatable bonds
2
Heavy atoms
16
Rings
2
Aromatic rings
2
Saturated rings
0
Aliphatic rings
0
Stereo centers
0
Undefined stereo
0
Formal charge
0
Heteroatoms
4
Covalent units
1
Fraction Csp3
0.25
Molar refractivity
59.81
Supplementary Information
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