Name: potassium α-isopropyl-4-chlorophenylacetate
SMILES:
CC(C)C(C(=O)[O-])c1ccc(Cl)cc1.[K+]Molecular Processing
Molecular formula
C11H12ClKO2
Molecular weight
250.77
Exact mass
250.0163
XLogP
-1.17
TPSA
40.13
H-bond donors
0
H-bond acceptors
2
Rotatable bonds
3
Heavy atoms
15
Rings
1
Aromatic rings
1
Saturated rings
0
Aliphatic rings
0
Stereo centers
1
Undefined stereo
1
Formal charge
0
Heteroatoms
4
Covalent units
2
Fraction Csp3
0.364
Molar refractivity
54.04
Supplementary Information
Details werden geladen…
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