SMILES:
O=Cc1ccc(OC2CCCCO2)cc1ClMolecular Processing
Molecular formula
C12H13ClO3
Molecular weight
240.69
Exact mass
240.0553
XLogP
3.06
TPSA
35.53
H-bond donors
0
H-bond acceptors
3
Rotatable bonds
3
Heavy atoms
16
Rings
2
Aromatic rings
1
Saturated rings
1
Aliphatic rings
1
Stereo centers
1
Undefined stereo
1
Formal charge
0
Heteroatoms
4
Covalent units
1
Fraction Csp3
0.417
Molar refractivity
61.06
Supplementary Information
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