Pyridine, 2,6-bis(chloromethyl)-, 1-oxide

Base Information

• Chemical Name: Pyridine, 2,6-bis(chloromethyl)-, 1-oxide
• CAS No.: 201160-41-0
• Molecular Formula: C7H7Cl2NO
• Molecular Weight: 192.04300
• DSSTox Substance ID: DTXSID70392025
• Nikkaji Number: J2.366.978A
• Wikidata: Q82189911
• Mol file: 201160-41-0.mol

Synonyms:201160-41-0;Pyridine, 2,6-bis(chloromethyl)-, 1-oxide;DTXSID70392025;AKOS006277769;pyridine,2,6-bis(chloromethyl)-,1-oxide;1-Oxylato-2,6-bis(chloromethyl)pyridinium;2,6-BIS(CHLOROMETHYL)PYRIDIN-1-IUM-1-OLATE

Chemical Property of Pyridine, 2,6-bis(chloromethyl)-, 1-oxide

Chemical Property:

• PSA: 25.46000
• LogP: 2.59270
• XLogP3: 0.7
• Hydrogen Bond Donor Count: 0
• Hydrogen Bond Acceptor Count: 1
• Rotatable Bond Count: 2
• Exact Mass: 190.9904692
• Heavy Atom Count: 11
• Complexity: 111

Purity/Quality:

98%min ^*data from raw suppliers

Safty Information:

• Pictogram(s):  
• Hazard Codes: 

MSDS Files:

SDS file from LookChem

Useful:

• Canonical SMILES: C1=CC(=[N+](C(=C1)CCl)[O-])CCl

Technology Process of Pyridine, 2,6-bis(chloromethyl)-, 1-oxide

There total 1 articles about Pyridine, 2,6-bis(chloromethyl)-, 1-oxide which guide to synthetic route it. The literature collected by LookChem mainly comes from the sharing of users and the free literature resources found by Internet computing technology. We keep the original model of the professional version of literature to make it easier and faster for users to retrieve and use. At the same time, we analyze and calculate the most feasible synthesis route with the highest yield for your reference as below:

synthetic route:

Reference yield: 92.0%

2,6-bis(chloromethyl)pyridine (3099-28-3) → 2,6-bis(chloromethyl)pyridine-N-oxide (201160-41-0)

Guidance literature:

With dihydrogen peroxide; In acetic acid; at 70 ℃; for 1.5h;

DOI:10.1039/b309336k

Reference yield: 94.0%

(S)-2-(2-nitrophenylsulfonamido)-N-((1R,2R)-2-(2-nitrophenylsulfonamido)cyclohexyl)-3-phenylpropanamide (1350538-34-9) + 2,6-bis(chloromethyl)pyridine-N-oxide (201160-41-0) → (4R,9R,12S)-12-benzyl-3,13-bis(2-nitrobenzenesulfonyl)-19-oxo-3,10,13,19-tetraazatricyclo[13.3.1.0(4,9)]-nonadeca-1(19),15,17-trien-11-one (1350538-43-0)

Guidance literature:

(S)-2-(2-nitrophenylsulfonamido)-N-((1R,2R)-2-(2-nitrophenylsulfonamido)cyclohexyl)-3-phenylpropanamide; With potassium carbonate; In acetonitrile; Reflux;

2,6-bis(chloromethyl)pyridine-N-oxide; With potassium iodide; In acetonitrile; for 3h; Reflux;

DOI:10.3987/COM-11-12249

Reference yield: 86.0%

potassium diphenylphosphine (15475-27-1,4346-39-8) + 2,6-bis(chloromethyl)pyridine-N-oxide (201160-41-0) → 2,6-[(diphenylphosphino)methyl]pyridine N-oxide P,P'-disulfide

Guidance literature:

potassium diphenylphosphine; 2,6-bis(chloromethyl)pyridine-N-oxide; In tetrahydrofuran; at 23 ℃; for 1h;

With sulfur; In tetrahydrofuran; for 1h; Further stages.;

DOI:10.1039/b309336k

upstream raw materials:

2,6-bis(chloromethyl)pyridine

Downstream raw materials:

(4R,9R,12S)-12-benzyl-3,13-bis(2-nitrobenzenesulfonyl)-19-oxo-3,10,13,19-tetraazatricyclo[13.3.1.0(4,9)]-nonadeca-1⁽¹⁹⁾,15,17-trien-11-one

(4R,9R)-12-benzyl-19-oxy-3,10,13,19-tetraazatricyclo[13.3.1.0(4,9)]nonadeca-1⁽¹⁹⁾,15,17-trien-11-one

(4R,9R,12S)-12-isopropyl-3,13-bis(2-nitrobenzenesulfonyl)-19-oxy-3,10,13,19-tetraazatricyclo[13.3.1.0(4,9)] nonadeca-1⁽¹⁹⁾,15,17-trien-11-one

(4R,9R)-3,13-bis(2-nitrobenzenesulfonyl)-19-oxy-3,10,13,19-tetraazatricyclo[13.3.1.0(4,9)]nonadeca-1⁽¹⁹⁾,15,17-trien-11-one

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