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Home > Encyclopedia > 2-Chloro-4-methyl-3-nitropyridine

2-Chloro-4-methyl-3-nitropyridine

2-Chloro-4-methyl-3-nitropyridine structure

2-Chloro-4-methyl-3-nitropyridine 

structure
  • CAS No:

    23056-39-5

  • Formula:

    C6H5ClN2O2

  • Chemical Name:

    2-Chloro-4-methyl-3-nitropyridine

  • Synonyms:

    Pyridine,2-chloro-4-methyl-3-nitro-;4-Picoline,2-chloro-3-nitro-;2-Chloro-4-methyl-3-nitropyridine;2-Chloro-3-nitro-4-methylpyridine;NSC 402977

  • Categories:

    Pharmaceutical Intermediates  >  Heterocyclic Compound

Description

Light yellow Cryst

2-Chloro-4-methyl-3-nitropyridine Basic Attributes

172.57

172.57

402977

DTXSID30323072

29333999

Characteristics

58.7

2

Yellow to beige Powder

1.4±0.1 g/cm3

52-52.9 °C

279.6°C at 760 mmHg

>230 °F

1.576

Refrigerator

0.00673mmHg at 25°C

Safety Information

III

6.1

UN2811

3

36/37/38-21/22

26-37/39-36/37/39-36

Xi,Xn

P261-P305 + P351 + P338

H315-H319-H335

|Warning|H315 (100%): Causes skin irritation [Warning Skin corrosion/irritation]|P261, P264, P271, P280, P302+P352, P304+P340, P305+P351+P338, P312, P321, P332+P313, P337+P313, P362, P403+P233, P405, and P501|Aggregated GHS information provided by 45 companies from 5 notifications to the ECHA C&L Inventory. Each notification may be associated with multiple companies.

2-Chloro-4-methyl-3-nitropyridine Use and Manufacturing

Methods of Manufacturing

Synthesis of the compound 10 The compound 9 (13g, 0.084mol) was added into 50mL of phosphorus oxychloride, the mixture was heated under reflux for 4 h, and distilled to remove excessive phosphorus oxychloride. The resulted product was recrystallized in 50mL of ethanol (75percent) to yield 11 g of a white solid product with yield of 75.3percent. The melting point: 51.7-52.1 °C(ethanol) (M.P. 52.0-52.9 °C was reported in reference)[J.O.C., 1955, 20, 1729-1731].

Uses

A cyclopropyldipyridodiazepinone derivative for use as non-nucleoside reverse transcriptase inhibitors.

Computed Properties

Molecular Weight:172.57
XLogP3:2
Hydrogen Bond Acceptor Count:3
Exact Mass:172.0039551
Monoisotopic Mass:172.0039551
Topological Polar Surface Area:58.7
Heavy Atom Count:11
Complexity:159
Covalently-Bonded Unit Count:1
Compound Is Canonicalized:Yes

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