이름: 3,3-bis(ethoxycarbonyl)bicyclo[3.2.0]heptane
SMILES:
CCOC(=O)C1(C(=O)OCC)CC2CCC2C1Molecular Processing
Molecular formula
C13H20O4
Molecular weight
240.3
Exact mass
240.1362
XLogP
1.92
TPSA
52.6
H-bond donors
0
H-bond acceptors
4
Rotatable bonds
4
Heavy atoms
17
Rings
2
Aromatic rings
0
Saturated rings
2
Aliphatic rings
2
Stereo centers
2
Undefined stereo
2
Formal charge
0
Heteroatoms
4
Covalent units
1
Fraction Csp3
0.846
Molar refractivity
61.15
Supplementary Information
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