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1-(2,4-Dinitrophenyl)-2-(2-methoxybenzylidene)hydrazine

HCID 9569558
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Basic information

CAS
1163-71-9
Standard SMILES
COc1ccccc1/C=N/Nc1ccc([N+](=O)[O-])cc1[N+](=O)[O-]
InChIKey
YWSBQMCOYBSYCS-OQLLNIDSSA-N
Molecular formula
C14H12N4O5
Average molar mass
316.27 g/mol
Monoisotopic mass
316.0807695

Names & identifiers

Preferred name
1-(2,4-Dinitrophenyl)-2-(2-methoxybenzylidene)hydrazine
IUPAC
N-[(E)-(2-methoxyphenyl)methylideneamino]-2,4-dinitroaniline
English name
2-Methoxybenzaldehyde 2,4-dinitrophenyl hydrazone
Molecular formula
C14H12N4O5
Molecular weight
316.27

Names & synonyms

1-(2,4-dinitrophenyl)-2-(2-methoxybenzylidene)hydrazine1163-71-9NSC405690N-[(E)-(2-methoxyphenyl)methylideneamino]-2,4-dinitroanilineo-Anisaldehyde, (2,4-dinitrophenyl)hydrazone2-Methoxybenzaldehyde 2,4-dinitrophenyl hydrazoneBenzaldehyde, 2-methoxy-, (2,4-dinitrophenyl)hydrazoneDTXSID10430435YWSBQMCOYBSYCS-OQLLNIDSSA-NAKOS001001926NSC-405690o-Anisaldehyde,4-dinitrophenyl)hydrazone
Show more names
2-Methoxybenzaldehyde 2,4-dinitrophenylhydrazone2-Methoxybenzaldehyde (2,4-dinitrophenyl)hydrazone #(e)-1-(2,4-dinitrophenyl)-2-(2-methoxybenzylidene)hydrazine(2E)-1-(2,4-Dinitrophenyl)-2-[(2-methoxyphenyl)methylidene]hydrazine

Database identifiers

CAS
1163-71-9
PubChem CID
9569558
DTXSID
DTXSID10430435
Nikkaji
J108.452F

Properties

Computed structural propertiesFilling in

XLogP
2.4
Topological polar surface area
125 Ų
Hydrogen bond donors
1
Hydrogen bond acceptors
7
Rotatable bonds
4
Heavy atoms
23
Formal charge
0
Complexity
447

Physicochemical properties

Melting point
254 °C · 254 °C
Boiling point
497.003 · 497.003±45.00 °C(Press: 760.00 Torr)(predicted)
Density
1.395 · 1.395±0.14 g/cm3(Temp: 25 °C; Press: 760 Torr)(predicted)
pka
11.246 · 11.246±0.10(predicted)

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