이름: 5-(1,3-Dioxolan-2-yl)-3,4-dihydro-1H-quinolin-2-one
SMILES:
O=C1CCc2c(cccc2C2OCCO2)N1Molecular Processing
Molecular formula
C12H13NO3
Molecular weight
219.24
Exact mass
219.0895
XLogP
1.62
TPSA
47.56
H-bond donors
1
H-bond acceptors
3
Rotatable bonds
1
Heavy atoms
16
Rings
3
Aromatic rings
1
Saturated rings
1
Aliphatic rings
2
Stereo centers
0
Undefined stereo
0
Formal charge
0
Heteroatoms
4
Covalent units
1
Fraction Csp3
0.417
Molar refractivity
58.04
Supplementary Information
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