Name: 1C
SMILES:
CCOC(=O)CC1CCc2cc(OC)ccc2C1=OMolecular Processing
Molecular formula
C15H18O4
Molecular weight
262.31
Exact mass
262.1205
XLogP
2.39
TPSA
52.6
H-bond donors
0
H-bond acceptors
4
Rotatable bonds
4
Heavy atoms
19
Rings
2
Aromatic rings
1
Saturated rings
0
Aliphatic rings
1
Stereo centers
1
Undefined stereo
1
Formal charge
0
Heteroatoms
4
Covalent units
1
Fraction Csp3
0.467
Molar refractivity
70.39
Supplementary Information
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