이름: 1,7-Diphenyl-1,6-heptadiene-3,5-dione
SMILES:
O=C(C=Cc1ccccc1)CC(=O)C=Cc1ccccc1Molecular Processing
Molecular formula
C19H16O2
Molecular weight
276.33
Exact mass
276.115
XLogP
3.94
TPSA
34.14
H-bond donors
0
H-bond acceptors
2
Rotatable bonds
6
Heavy atoms
21
Rings
2
Aromatic rings
2
Saturated rings
0
Aliphatic rings
0
Stereo centers
0
Undefined stereo
0
Formal charge
0
Heteroatoms
2
Covalent units
1
Fraction Csp3
0.053
Molar refractivity
85.58
Supplementary Information
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