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4-(4-Nitrophenoxy)pyridine

HCID 44558538
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Basic information

CAS
4783-83-9
Standard SMILES
O=[N+]([O-])c1ccc(Oc2ccncc2)cc1
InChIKey
WNLPFSUCTGPURU-UHFFFAOYSA-N
Molecular formula
C11H8N2O3
Average molar mass
216.19 g/mol
Monoisotopic mass
216.05349212

Names & identifiers

Preferred name
4-(4-Nitrophenoxy)pyridine
IUPAC
4-(4-nitrophenoxy)pyridine
English name
4-(p-Nitrophenoxy)-pyridine
Molecular formula
C11H8N2O3
Molecular weight
216.19

Names & synonyms

4-(4-nitrophenoxy)pyridine4783-83-94-(P-NITROPHENOXY)-PYRIDINEMFCD07778622Pyridine, 4-(4-nitrophenoxy)-SCHEMBL3997433SCHEMBL13906250SCHEMBL277249394-(P-NITROPHENoxy)pyRIDINEDTXSID10659427WNLPFSUCTGPURU-UHFFFAOYSA-N4-(4-pyridinyloxy)-1-nitrobenzene
Show more names
STL140868AKOS005746756AC-26409AS-59176SY258817DB-080810CS-0003873F210974

Database identifiers

CAS
4783-83-9
PubChem CID
44558538
DTXSID
DTXSID10659427

Properties

Computed structural properties

XLogP
1.9
Topological polar surface area
67.9 Ų
Hydrogen bond donors
0
Hydrogen bond acceptors
4
Rotatable bonds
2
Heavy atoms
16
Formal charge
0
Complexity
228

Physicochemical properties

Melting point
79 · 79-81 °C(Solv: ligroine (8032-32-4))
Boiling point
345 · 345.0±17.0 °C(Predicted)
Density
1.309 · 1.309±0.06 g/cm3(Predicted)
storage temp.
2 · 2-8°C
pka
4.24 · 4.24±0.10(Predicted)
Symbol(GHS)
7 · GHS07
Signal word
Warning
Hazard statements
302 · H302-H315-H319-H335
Precautionary statements
261 · P261-P305+P351+P338

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
Hazard statements
H302-H315-H319-H335
Precautionary statements
P261-P305+P351+P338

Related reactions

6 records
New reaction record
HRID 1725690 reaction equation
HRID 1725690As productuspto-grants-2009_02
HRID 1770840 reaction equation
HRID 1770840As productuspto-grants-2016_02
HRID 1947596 reaction equation
HRID 1947596As productuspto-grants-2013_03
HRID 1962244 reaction equation
HRID 1962244As productuspto-grants-2013_04
HRID 2337643 reaction equation
HRID 2337643As productTraining data from https://doi.org/10.1039/C8SC04228D (10/10)
HRID 2408390 reaction equation
HRID 2408390As productuspto-grants-2014_08

Compound notes

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