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HomeProduct name list2,6-Dichloro-3-nitropyridine

2,6-Dichloro-3-nitropyridine

  • CAS NO.:16013-85-7
  • Empirical Formula: C5H2Cl2N2O2
  • Molecular Weight: 192.99
  • MDL number: MFCD00006234
  • EINECS: 240-151-1
  • SAFETY DATA SHEET (SDS)
  • Update Date: 2024-05-13 18:00:15
2,6-Dichloro-3-nitropyridine Structural

What is 2,6-Dichloro-3-nitropyridine?

Chemical properties

yellow crystalline powder or chunks

The Uses of 2,6-Dichloro-3-nitropyridine

2,6-Dichloro-3-nitropyridine was used:

  • in the synthesis of pyridyldifluoroacetates
  • as starting reagent in the preparation of bicyclooxacalixhetarene

Definition

Nitropyridine nucleus played a pivotal role in the development of different medicinal agents and in the field of agrochemicals. It is seen from the current literature that pyridine derivatives have been developed and used as insecticidal agents. Nitrated pyridines and their derivatives are important intermediates in synthesis of heterocyclic compounds in dyes and pharmaceutical products. Fused heterocycles containing nitropyridine systems have been associated with several biological and medicinal activities including antiolytic, antiviral and anti-inflammatory profiles.

General Description

2,6-Dichloro-3-nitropyridine undergoes macrocyclic condensation reaction with resorcinol derivatives to yield chiral tetraoxacalix[2]arene[2]pyridines.

Structure and conformation

The asymmetric unit of 2,6-Dichloro-3-nitropyridine consists of two crystallographically independent mol-ecules. The pyridine ring in each mol-ecule is essentially planar, with maximum deviations of 0.004 (4) and 0.007 (4)Å. Short Cl-O [3.09?(3) and 3.13 (4)Å] and Cl-Cl [3.38 (12)Å] contacts were observed. No significant inter-molecular inter-actions were observed in the crystal packing.
2,6-Dichloro-3-nitropyridine

Properties of 2,6-Dichloro-3-nitropyridine

Melting point: 55-60 °C(lit.)
Boiling point: 295.5±35.0 °C(Predicted)
Density  1.6791 (rough estimate)
refractive index  1.6100 (estimate)
Flash point: >230 °F
storage temp.  Keep in dark place,Sealed in dry,Room Temperature
solubility  soluble in Methanol
form  Liquid
pka -5.76±0.10(Predicted)
color  Clear colorless to light yellow
BRN  1619741
InChI InChI=1S/C5H2Cl2N2O2/c6-4-2-1-3(9(10)11)5(7)8-4/h1-2H
CAS DataBase Reference 16013-85-7(CAS DataBase Reference)

Safety information for 2,6-Dichloro-3-nitropyridine

Signal word Warning
Pictogram(s)
ghs
Exclamation Mark
Irritant
GHS07
GHS Hazard Statements H315:Skin corrosion/irritation
H317:Sensitisation, Skin
H319:Serious eye damage/eye irritation
H335:Specific target organ toxicity, single exposure;Respiratory tract irritation
Precautionary Statement Codes P280:Wear protective gloves/protective clothing/eye protection/face protection.
P302+P352:IF ON SKIN: wash with plenty of soap and water.
P305+P351+P338:IF IN EYES: Rinse cautiously with water for several minutes. Remove contact lenses, if present and easy to do. Continuerinsing.

Computed Descriptors for 2,6-Dichloro-3-nitropyridine

InChIKey SHCWQWRTKPNTEM-UHFFFAOYSA-N
SMILES C1(Cl)=NC(Cl)=CC=C1[N+]([O-])=O

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