Название: 1-(1,3-dioxolan-2-ylmethyl)-4-chloroquinolin-2(1H)-one
SMILES:
O=c1cc(Cl)c2ccccc2n1CC1OCCO1Molecular Processing
Molecular formula
C13H12ClNO3
Molecular weight
265.7
Exact mass
265.0506
XLogP
2.03
TPSA
40.46
H-bond donors
0
H-bond acceptors
3
Rotatable bonds
2
Heavy atoms
18
Rings
3
Aromatic rings
2
Saturated rings
1
Aliphatic rings
1
Stereo centers
0
Undefined stereo
0
Formal charge
0
Heteroatoms
5
Covalent units
1
Fraction Csp3
0.308
Molar refractivity
68.91
Supplementary Information
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