Name: Methyl 2-(2-iodophenyl)acetate
SMILES:
COC(=O)Cc1ccccc1IMolecular Processing
Molecular formula
C9H9IO2
Molecular weight
276.07
Exact mass
275.9647
XLogP
2.01
TPSA
26.3
H-bond donors
0
H-bond acceptors
2
Rotatable bonds
2
Heavy atoms
12
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
0.222
Molar refractivity
54.88
Supplementary Information
Details werden geladen…
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