名称: 2
SMILES:
COC(OC)c1cc2c(cc1CO)OCO2Molecular Processing
Molecular formula
C11H14O5
Molecular weight
226.23
Exact mass
226.0841
XLogP
1.2
TPSA
57.15
H-bond donors
1
H-bond acceptors
5
Rotatable bonds
4
Heavy atoms
16
Rings
2
Aromatic rings
1
Saturated rings
0
Aliphatic rings
1
Stereo centers
0
Undefined stereo
0
Formal charge
0
Heteroatoms
5
Covalent units
1
Fraction Csp3
0.455
Molar refractivity
55.25
Supplementary Information
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