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N-(4-iodophenyl)-1-[4-[(4-iodophenyl)iminomethyl]phenyl]methanimine

HCID 317650
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Basic information

CAS
81431-01-8
Standard SMILES
Ic1ccc(N=Cc2ccc(C=Nc3ccc(I)cc3)cc2)cc1
InChIKey
BKFHFOFWZMIUCR-UHFFFAOYSA-N
Molecular formula
C20H14I2N2
Average molar mass
536.1 g/mol
Monoisotopic mass
535.92464

Overview

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Names & identifiers

Preferred name
N-(4-iodophenyl)-1-[4-[(4-iodophenyl)iminomethyl]phenyl]methanimine
IUPAC
N-(4-iodophenyl)-1-[4-[(4-iodophenyl)iminomethyl]phenyl]methanimine
English name
N,N'-(1,4-Phenylenedimethylidyne)bis(4-iodoaniline)
Molecular formula
C20H14I2N2
Molecular weight
536.1475

Names & synonyms

81431-01-8N-(4-iodophenyl)-1-[4-[(4-iodophenyl)iminomethyl]phenyl]methanimineNSC250805DTXSID00312150STK031710AKOS000483984NSC-250805DS-011610(E,E)-(1,4-Phenylene)bis[N-(4-iodophenyl)methanimine]N,4-PHENYLENEDIMETHYLIDYNE)BIS[4-IODOBENZENAMINE]N,N'-(1,4-Phenylenebis(methanylylidene))bis(4-iodoaniline)N,N'-[benzene-1,4-diyldi(E)methylylidene]bis(4-iodoaniline)
Show more names
N,N'-(1,4-Phenylenedimethylidyne)bis(4-iodoaniline)N,N'-(1,4-Phenylenedimethylidyne)bis(4-iodoaniline)N,N'-[1,4-phenylenedi(methylylidene)]bis(4-iodoaniline)Benzenamine, N,N'-(1,4-phenylenedimethylidyne)bis[4-iodo- (9CI)
4-iodo-N-[(E)-(4-{(E)-[(4-iodophenyl)imino]methyl}phenyl)methylidene]aniline

Database identifiers

CAS
81431-01-8
PubChem CID

Properties

Computed structural properties

XLogP
5.8
Topological polar surface area
24.7 Ų
Hydrogen bond donors
0
Hydrogen bond acceptors
2
Rotatable bonds
4
Heavy atoms
24
Formal charge
0
Complexity
373

Physicochemical properties

Boiling point
564.7 · 564.7±45.0 °C(Predicted)
Density
1.7 · 1.70±0.1 g/cm3(Predicted)
pka
1.94 · 1.94±0.50(Predicted)
Hazard statements
413 · H413

Safety & regulation

Safety information is for reference only and does not replace the supplier’s Safety Data Sheet (SDS), applicable regulations, or professional assessment.

Safety data

Hazard statements
H413

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Compound notes

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On this pageBasic informationOverviewNames & identifiersPropertiesSafety & regulationRelated reactionsCompound notes
317650
DTXSID
DTXSID00312150