CAS
958230-19-8 Purity
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958230-19-8 Purity
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The molecular formula is C18H19IO6.
It was created on 2009-09-25 and last modified on 2023-12-30.
The IUPAC name is (3,4-dimethoxyphenyl) 2-(2-iodo-4,5-dimethoxyphenyl)acetate.
The InChIKey is WJFQIYMLPQDFQK-UHFFFAOYSA-N.
There are 6 hydrogen bond acceptors.
The XLogP3-AA value is 3.8.
The exact mass is 458.02264 g/mol.
There are 8 rotatable bonds.
The topological polar surface area is 63.2 Ų.
Yes, the compound is canonicalized.