Название: methyl 2-[(2-methyl-4-oxo-4H-chromen-8-yl)methylene]-3-oxobutanoate
SMILES:
COC(=O)C(=Cc1cccc2c(=O)cc(C)oc12)C(C)=OMolecular Processing
Molecular formula
C16H14O5
Molecular weight
286.28
Exact mass
286.0841
XLogP
2.25
TPSA
73.58
H-bond donors
0
H-bond acceptors
5
Rotatable bonds
3
Heavy atoms
21
Rings
2
Aromatic rings
2
Saturated rings
0
Aliphatic rings
0
Stereo centers
0
Undefined stereo
0
Formal charge
0
Heteroatoms
5
Covalent units
1
Fraction Csp3
0.188
Molar refractivity
77.9
Supplementary Information
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