N-(4-iodophenyl)-1-(4-phenylmethoxyphenyl)methanimine
Basic information
- CAS
70627-49-5- Standard SMILES
Ic1ccc(N=Cc2ccc(OCc3ccccc3)cc2)cc1- InChIKey
UTXXGKMGKBMYBU-UHFFFAOYSA-N- Molecular formula
- C20H16INO
- Average molar mass
- 413.3 g/mol
- Monoisotopic mass
- 413.02766
Overview
See also: N-(4-Benzyloxybenzylidene)-4-iodoaniline (annotation moved to).
Names & identifiers
- Preferred name
- N-(4-iodophenyl)-1-(4-phenylmethoxyphenyl)methanimine
- IUPAC
- N-(4-iodophenyl)-1-(4-phenylmethoxyphenyl)methanimine
- English name
- N-(4-Benzyloxybenzylidene)-4-iodoaniline
- Molecular formula
- C20H16INO
- Molecular weight
- 413.25
Names & synonyms
N-(4-iodophenyl)-1-(4-phenylmethoxyphenyl)methanimine70627-49-5(E)-1-[4-(benzyloxy)phenyl]-N-(4-iodophenyl)methanimineDTXSID40365206MFCD00019025STK028970AKOS000482980Ic1ccc(cc1)N=Cc1ccc(cc1)OCc1ccccc1ZINC000002162178ST45029791N((E)(4(benzyloxy)phenyl)methylidene)4iodoanilineN-{(E)-[4-(benzyloxy)phenyl]methylidene}-4-iodoaniline
Show more names
N-(4-Benzyloxybenzylidene)-4-iodoanilineBenzenamine, 4-iodo-N-[[4-(phenylmethoxy)phenyl]methylene]-
1-[(1E)-2-(4-iodophenyl)-2-azavinyl]-4-(phenylmethoxy)benzene
Database identifiers
- CAS
70627-49-5- PubChem CID
- 1808441
- DTXSID
DTXSID40365206
Properties
Computed structural properties
- XLogP
- 5.3
- Topological polar surface area
- 21.6 Ų
- Hydrogen bond donors
- 0
- Hydrogen bond acceptors
- 2
- Rotatable bonds
- 5
- Heavy atoms
- 23
- Formal charge
- 0
- Complexity
- 351
Physicochemical properties
- Boiling point
- 506.9 · 506.9±40.0 °C(Predicted)
- Density
- 1.38 · 1.38±0.1 g/cm3(Predicted)
- pka
- 3.3 · 3.30±0.50(Predicted)
- Symbol(GHS)
- 7 · GHS07,GHS09
- Signal word
- Warning
- Hazard statements
- 317 · H317-H410
- Precautionary statements
- 261 · P261-P272-P280-P302+P352-P333+P313-P321-P363-P501-P273-P391-P501
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
- Signal word
- Warning
- Symbol(GHS)
- GHS07,GHS09
- Hazard statements
- H317-H410
- Precautionary statements
- P261-P272-P280-P302+P352-P333+P313-P321-P363-P501-P273-P391-P501
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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