SMILES:
CCCCCc1c(OCCCCCC(=O)O)ccc(Cl)c1ClMolecular Processing
Molecular formula
C17H24Cl2O3
Molecular weight
347.28
Exact mass
346.1102
XLogP
5.75
TPSA
46.53
H-bond donors
1
H-bond acceptors
2
Rotatable bonds
11
Heavy atoms
22
Rings
1
Aromatic rings
1
Saturated rings
0
Aliphatic rings
0
Stereo centers
0
Undefined stereo
0
Formal charge
0
Heteroatoms
5
Covalent units
1
Fraction Csp3
0.588
Molar refractivity
91.29
Supplementary Information
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