1,1,1,2,3,3,3-Heptafluoro-2-nitrosopropane

Base Information

• Chemical Name: 1,1,1,2,3,3,3-Heptafluoro-2-nitrosopropane
• CAS No.: 422-98-0
• Molecular Formula: C3F7 N O
• Molecular Weight: 199.028
• Hs Code.: 2904909090
• DSSTox Substance ID: DTXSID50379278
• Wikidata: Q81985781
• Mol file: 422-98-0.mol

Synonyms:422-98-0;1,1,1,2,3,3,3-heptafluoro-2-nitrosopropane;Heptafluoro-2-nitrosopropane;Perfluoro-2-nitrosopropane;Isoheptafluoronitrosopropane;2-Nitrosoperfluoropropane;DTXSID50379278;WOJKTSOYJLOODF-UHFFFAOYSA-N;FT-0626898;A825844;1,1,1,2,3,3,3-heptakis(fluoranyl)-2-nitroso-propane

Chemical Property of 1,1,1,2,3,3,3-Heptafluoro-2-nitrosopropane

Chemical Property:

• Vapor Pressure: 3270mmHg at 25°C
• Refractive Index: 1.28
• Boiling Point: °Cat760mmHg
• Flash Point: °C
• PSA: 29.43000
• Density: 1.66g/cm³
• LogP: 2.54320
• XLogP3: 2.1
• Hydrogen Bond Donor Count: 0
• Hydrogen Bond Acceptor Count: 9
• Rotatable Bond Count: 0
• Exact Mass: 198.98681076
• Heavy Atom Count: 12
• Complexity: 166

Purity/Quality:

98%Min ^*data from raw suppliers

HEPTAFLUORO-2-NITROSOPROPANE 95.00% ^*data from reagent suppliers

Safty Information:

• Hazard Codes: T

MSDS Files:

SDS file from LookChem

Useful:

• Canonical SMILES: C(C(F)(F)F)(C(F)(F)F)(N=O)F

Technology Process of 1,1,1,2,3,3,3-Heptafluoro-2-nitrosopropane

There total 3 articles about 1,1,1,2,3,3,3-Heptafluoro-2-nitrosopropane 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:

perfluoropropylene (116-15-4,13429-24-8,25120-07-4,6792-31-0) → heptafluoro-2-nitrosopropane (422-98-0)

Guidance literature:

With nitrosyl fluoride; at 120 ℃; for 13h;

DOI:10.1021/jo01059a011

Reference yield:

perfluoropropylene (116-15-4,13429-24-8,25120-07-4,6792-31-0) → 1-chlorohexafluoro-2-nitrosopropane (662-14-6) + heptafluoro-2-nitrosopropane (422-98-0)

Guidance literature:

With nitrosylchloride; cesium fluoride; In sulfolane; at 20 ℃; for 96h; Product distribution; other method;

DOI:10.1016/S0022-1139(00)85122-2

Reference yield:

→ heptafluoro-2-nitrosopropane (422-98-0)

Guidance literature:

Heptafluor-2-iodpropan, NO (Gasphase, Bestrahlung mit Hg-Lampe);

upstream raw materials:

perfluoropropylene

Downstream raw materials:

1,1,1,3,3,3-hexafluoro-propan-2-one O-(2,2,2-trifluoro-1,1-bis-trifluoromethyl-ethyl)-oxime

O-(Fluorodiphenylmethyl)hexafluoroacetone oxime

1,1,1,3,3,3-Hexafluoro-propan-2-one O-phenyl-oxime

Refernces

• 1、 Banks, Ronald E.,Dickinson, Neil,Morrissey, Alan P.,Richards, Adrian. "FLUOROCARBON DERIVATIVES OF NITROGEN. PART 10. PREPARATION OF HEPTAFLUORO- AND 1-CHLOROHEXAFLUORO-2-NITROSOPROPANE, AND CONVERSION OF THE LATTER TO CHLOROPENTAFLUOROACETONE OXIME". . p. 87 - 92. Retrieved 2007/10/02.