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Chem Methyl 2 Iodobenzoate | Cheminformatics

Methyl 2-Iodobenzoate


  • SKU Code: CH136847
Chemical Name - Methyl 2-Iodobenzoate
Mol Weight - 262.042
Smiles - COC(c(cccc1)c1I)=O
Property Name Property Value
Mol NameMethyl 2-Iodobenzoate
Molweight262.042
Monoisotopic Mass261.949078
Clogp2.0097
Clogs-2.773
H Acceptors2
Total Surface Area139.55
Relative Psa0.1651
Polar Surface Area26.3
Druglikeness-3.0893
Mutagenicnone
Tumorigenicnone
Reproductive Effectivenone
Irritantnone
Shape Index0.63636
Molecular Flexibility0.39443
Molecular Complexity0.72218
Fragments1
Non H Atoms11
Non Ch Atoms3
Electronegative Atoms3
Rotatable Bonds2
Rings Closures1
Small Rings1
Aromatic Rings1
Aromatic Atoms6
Sp3 Atoms2
SmilesCOC(c(cccc1)c1I)=O
InChIKey
InChIC8H7O2I

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1 - Methyl 2-Iodobenzoate
2 - Methyl 2-Iodobenzoate
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