이름: 2-(2-furyl)-5-hydroxy-1,3-dioxane
SMILES:
OC1COC(c2ccco2)OC1Molecular Processing
Molecular formula
C8H10O4
Molecular weight
170.16
Exact mass
170.0579
XLogP
0.69
TPSA
51.83
H-bond donors
1
H-bond acceptors
4
Rotatable bonds
1
Heavy atoms
12
Rings
2
Aromatic rings
1
Saturated rings
1
Aliphatic rings
1
Stereo centers
0
Undefined stereo
0
Formal charge
0
Heteroatoms
4
Covalent units
1
Fraction Csp3
0.5
Molar refractivity
39.36
Supplementary Information
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