SMILES:
COc1ccc2oc(C(=O)CCCCCl)c(C)c2c1Molecular Processing
Molecular formula
C15H17ClO3
Molecular weight
280.75
Exact mass
280.0866
XLogP
4.34
TPSA
39.44
H-bond donors
0
H-bond acceptors
3
Rotatable bonds
6
Heavy atoms
19
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
0.4
Molar refractivity
76.4
Supplementary Information
Récupération des détails…
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