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2-{(E)-[(2-hydroxy-5-propylphenyl)imino]methyl}-4,6-diiodophenol

HCID 5228078
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Basic information

CAS
5533-75-5
Standard SMILES
CCCc1ccc(O)c(N=Cc2cc(I)cc(I)c2O)c1
InChIKey
FTZRKSBCRGSGKI-UHFFFAOYSA-N
Molecular formula
C16H15I2NO2
Average molar mass
507.1 g/mol
Monoisotopic mass
506.91922

Names & identifiers

Preferred name
2-{(E)-[(2-hydroxy-5-propylphenyl)imino]methyl}-4,6-diiodophenol
IUPAC
2-[(2-hydroxy-5-propylphenyl)iminomethyl]-4,6-diiodophenol

Names & synonyms

2-{(E)-[(2-hydroxy-5-propylphenyl)imino]methyl}-4,6-diiodophenol5533-75-52-[(E)-[(2-HYDROXY-5-PROPYLPHENYL)IMINO]METHYL]-4,6-DIIODOPHENOLDTXSID00970673STK028838AKOS0014874306-[(2-hydroxy-5-propylanilino)methylidene]-2,4-diiodocyclohexa-2,4-dien-1-one2-{[(2-HYDROXY-5-PROPYLPHENYL)IMINO]METHYL}-4,6-DIIODOPHENOL

Database identifiers

CAS
5533-75-5
PubChem CID
5228078
DTXSID
DTXSID00970673

Properties

Computed structural properties

XLogP
5.2
Topological polar surface area
52.8 Ų
Hydrogen bond donors
2
Hydrogen bond acceptors
3
Rotatable bonds
4
Heavy atoms
21
Formal charge
0
Complexity
353

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