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Iodine, bis[(2,4-dichlorophenoxy)acetato-O1]phenyl-

HCID 13637786
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Basic information

CAS
57357-22-9
Standard SMILES
O=C(COc1ccc(Cl)cc1Cl)OI(OC(=O)COc1ccc(Cl)cc1Cl)c1ccccc1
InChIKey
IYMOANHGQDMEGD-UHFFFAOYSA-N
Molecular formula
C22H15Cl4IO6
Average molar mass
644.1 g/mol
Monoisotopic mass
641.86675

Names & identifiers

Preferred name
Iodine, bis[(2,4-dichlorophenoxy)acetato-O1]phenyl-
IUPAC
[[2-(2,4-dichlorophenoxy)acetyl]oxy-phenyl-λ3-iodanyl] 2-(2,4-dichlorophenoxy)acetate

Names & synonyms

Iodine, bis[(2,4-dichlorophenoxy)acetato-O1]phenyl-DTXSID70122202857357-22-9Bis{[(2,4-dichlorophenoxy)acetyl]oxy}(phenyl)-lambda~3~-iodane

Database identifiers

CAS
57357-22-9
PubChem CID
13637786
DTXSID
DTXSID701222028

Properties

Computed structural properties

XLogP
8.7
Topological polar surface area
71.1 Ų
Hydrogen bond donors
0
Hydrogen bond acceptors
6
Rotatable bonds
11
Heavy atoms
33
Formal charge
0
Complexity
594

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