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2D Structure

2-Iodoanisole


  • SKU Code: CH141632
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Chemical Name - 2-Iodoanisole
Mol Weight - 234.032
Smiles - COc(cccc1)c1I
Property Name Property Value
Mol Name2-Iodoanisole
Molweight234.032
Monoisotopic Mass233.954163
Clogp2.0267
Clogs-2.65
H Acceptors1
Total Surface Area121.8
Relative Psa0.082102
Polar Surface Area9.23
Druglikeness-0.95884
Mutagenicnone
Tumorigenicnone
Reproductive Effectivenone
Irritantnone
Shape Index0.66667
Molecular Flexibility0.28257
Molecular Complexity0.7083
Fragments1
Non H Atoms9
Non Ch Atoms2
Electronegative Atoms2
Rotatable Bonds1
Rings Closures1
Small Rings1
Aromatic Rings1
Aromatic Atoms6
Sp3 Atoms2
SmilesCOc(cccc1)c1I
InChIKeyInChI=1S/C7H7IO/c1-9-7-5-3-2-4-6(7)8/h2-5H,1H3
InChIDVQWNQBEUKXONL-UHFFFAOYSA-N

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