SMILES:
COC(=O)CCc1ccc(OCc2ccc(CCl)cc2)cc1Molecular Processing
Molecular formula
C18H19ClO3
Molecular weight
318.8
Exact mass
318.1023
XLogP
4.11
TPSA
35.53
H-bond donors
0
H-bond acceptors
3
Rotatable bonds
7
Heavy atoms
22
Rings
2
Aromatic rings
2
Saturated rings
0
Aliphatic rings
0
Stereo centers
0
Undefined stereo
0
Formal charge
0
Heteroatoms
4
Covalent units
1
Fraction Csp3
0.278
Molar refractivity
87.11
Supplementary Information
Details werden geladen…
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