이름: 7-benzyloxy-4-hydroxycoumarin
SMILES:
O=c1cc(O)c2ccc(OCc3ccccc3)cc2o1Molecular Processing
Molecular formula
C16H12O4
Molecular weight
268.27
Exact mass
268.0736
XLogP
3.08
TPSA
59.67
H-bond donors
1
H-bond acceptors
4
Rotatable bonds
3
Heavy atoms
20
Rings
3
Aromatic rings
3
Saturated rings
0
Aliphatic rings
0
Stereo centers
0
Undefined stereo
0
Formal charge
0
Heteroatoms
4
Covalent units
1
Fraction Csp3
0.062
Molar refractivity
74.92
Supplementary Information
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