SMILES:
CCOC(=O)c1ccc(Cl)c(C(C)C)c1Molecular Processing
Molecular formula
C12H15ClO2
Molecular weight
226.7
Exact mass
226.0761
XLogP
3.64
TPSA
26.3
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
0
Undefined stereo
0
Formal charge
0
Heteroatoms
3
Covalent units
1
Fraction Csp3
0.417
Molar refractivity
61.5
Supplementary Information
Details werden geladen…
An 3 Reaktionen beteiligt→