이름: 2,3-ethylenedioxybenzaldehyde
SMILES:
O=Cc1cccc2c1OCCO2Molecular Processing
Molecular formula
C9H8O3
Molecular weight
164.16
Exact mass
164.0473
XLogP
1.27
TPSA
35.53
H-bond donors
0
H-bond acceptors
3
Rotatable bonds
1
Heavy atoms
12
Rings
2
Aromatic rings
1
Saturated rings
0
Aliphatic rings
1
Stereo centers
0
Undefined stereo
0
Formal charge
0
Heteroatoms
3
Covalent units
1
Fraction Csp3
0.222
Molar refractivity
42.82
Supplementary Information
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