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N-(p-Methoxybenzylidene)-p-nitroaniline

HCID 262174
NotesReactions
Basic informationNames & identifiersPropertiesRelated reactionsCompound notes
Substructure searchFind similar structures

Basic information

CAS
15450-66-5
Standard SMILES
COc1ccc(C=Nc2ccc([N+](=O)[O-])cc2)cc1
InChIKey
YZJSVLVRDFIMHX-UHFFFAOYSA-N
Molecular formula
C14H12N2O3
Average molar mass
256.26 g/mol
Monoisotopic mass
256.08479224

Names & identifiers

Preferred name
N-(p-Methoxybenzylidene)-p-nitroaniline
IUPAC
1-(4-methoxyphenyl)-N-(4-nitrophenyl)methanimine

Names & synonyms

N-(p-Methoxybenzylidene)-p-nitroanilineAniline, N-(p-methoxybenzylidene)-p-nitro-N-(4-Methoxybenzylidene)-4-nitroaniline4-(4-Methoxybenzylideneamino)nitrobenzene15450-66-5Benzenamine, N-((4-methoxyphenyl)methylene)-4-nitro-Benzenamine, N-[(4-methoxyphenyl)methylene]-4-nitro-p-methoxybenzylidene-(4-nitrophenyl)-amineN-[(4-Methoxyphenyl)methylidene]-4-nitroanilineNSC95598NCIOpen2_005994SCHEMBL3431012
Show more names
SCHEMBL3431014YZJSVLVRDFIMHX-XNTDXEJSSA-NDTXSID401376925NSC-95598AKOS0243348504-nitro-4'-methoxy-N-benzylideneaniline(4-Methoxy-benzyliden)-(4-nitro-phenyl)-amin(4-Methoxy-benzylidene)-(4-nitro-phenyl)-amin

Database identifiers

CAS
15450-66-5
PubChem CID
262174
DTXSID
DTXSID401376925
Nikkaji
J1.064.586G

Properties

Computed structural properties

XLogP
3
Topological polar surface area
67.4 Ų
Hydrogen bond donors
0
Hydrogen bond acceptors
4
Rotatable bonds
3
Heavy atoms
19
Formal charge
0
Complexity
311

Related reactions

7 records
New reaction record
HRID 115767 reaction equation
HRID 115767As reactantTraining data from https://doi.org/10.1039/C8SC04228D (2/10)
HRID 506839 reaction equation
HRID 506839As productuspto-grants-2010_08
HRID 506840 reaction equation
HRID 506840As reactantuspto-grants-2010_08
HRID 802064 reaction equation
HRID 802064As reactantTest data from https://doi.org/10.1039/C8SC04228D
HRID 2115187 reaction equation
HRID 2115187As productuspto-grants-2008_10
HRID 2115188 reaction equation
HRID 2115188As reactantuspto-grants-2008_10
HRID 2147051 reaction equation
HRID 2147051As productTraining data from https://doi.org/10.1039/C8SC04228D (4/10)

Compound notes

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