1,1,1,2,2,3,3,4,4-Nonafluorobutane

Base Information

• Chemical Name: 1,1,1,2,2,3,3,4,4-Nonafluorobutane
• CAS No.: 375-17-7
• Molecular Formula: C4H F9
• Molecular Weight: 220.038
• Hs Code.: 2903399090
• DSSTox Substance ID: DTXSID20379700
• Nikkaji Number: J793.551J
• Wikidata: Q81985804
• ChEMBL ID: CHEMBL504358
• Mol file: 375-17-7.mol

Synonyms:1,1,1,2,2,3,3,4,4-nonafluorobutane;1H-NONAFLUOROBUTANE;375-17-7;C4F9H;HFC-329p;SCHEMBL37506;CHEMBL504358;DTXSID20379700;MFCD00272355;AKOS016015310;1,1,2,2,3,3,4,4,4-nonafluorobutane;FT-0607906;1,1,1,2,2,3,3,4,4-nonakis(fluoranyl)butane;A823717

Chemical Property of 1,1,1,2,2,3,3,4,4-Nonafluorobutane

Chemical Property:

• Vapor Pressure: 976mmHg at 25°C
• Refractive Index: 1.24
• Boiling Point: 17.9°Cat760mmHg
• Flash Point: °C
• PSA: 0.00000
• Density: 1.526g/cm³
• LogP: 3.08440
• XLogP3: 3.5
• Hydrogen Bond Donor Count: 0
• Hydrogen Bond Acceptor Count: 9
• Rotatable Bond Count: 2
• Exact Mass: 219.99345349
• Heavy Atom Count: 13
• Complexity: 177

Purity/Quality:

98%Min ^*data from raw suppliers

1H-Nonafluorobutane 99% ^*data from reagent suppliers

Safty Information:

• Hazard Codes: Xi
• Safety Statements: 23

MSDS Files:

SDS file from LookChem

Useful:

• Canonical SMILES: C(C(C(C(F)(F)F)(F)F)(F)F)(F)F

Technology Process of 1,1,1,2,2,3,3,4,4-Nonafluorobutane

There total 12 articles about 1,1,1,2,2,3,3,4,4-Nonafluorobutane 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: 89.5%

1-iodo-2,2,3,3,4,4,5,5,5-nonafluorobutane (423-39-2) + N,N-dimethyl-formamide (68-12-2,33513-42-7) → nonafluorobutane (375-17-7) + perfluoropentanal (375-53-1) + 2,2,3,3,4,4,5,5,5-Nonafluoro-pentanoic acid dimethylamide

Guidance literature:

With lead(II) bromide; aluminium; for 1.5h; Ambient temperature;

DOI:10.1016/S0022-1139(00)80105-0

Reference yield: 79.0%

perfluoro-2-hexanone (755-27-1) → nonafluorobutane (375-17-7) + trifluoroacetic acid (76-05-1)

Guidance literature:

With sodium hydroxide; sulfuric acid; Product distribution; 1.) H₂O, reflux, 30 min, 2.) reflux;

DOI:10.1007/BF01141717

Reference yield: 60.0%

1-iodo-2,2,3,3,4,4,5,5,5-nonafluorobutane (423-39-2) + allyl alcohol (107-18-6) → nonafluorobutane (375-17-7) + Perfluorooctane (307-34-6) + (E)-4,4,5,5,6,6,7,7,7-Nonafluoro-hept-2-en-1-ol (72016-05-8) + 3?(perfluoro?n?butyl)?1,2?epoxypropane (81190-28-5)

Guidance literature:

With potassium hydroxide; 2,2'-azobis(isobutyronitrile); In 1,2-dichloro-ethane; at 70 ℃; for 2h;

DOI:10.1016/S0022-1139(00)00214-1

upstream raw materials:

1-iodo-2,2,3,3,4,4,5,5,5-nonafluorobutane

perfluoro-2-hexanone

N,N-dimethyl-formamide

cyclohexene

Refernces

• 1、 Paterová, Jana,Skalicky, Martin,Rybá?ková, Markéta,Kví?alová, Magdalena,Cva?ka, Josef,Kví?ala, Jaroslav. "Synthesis of 2-(perfluoroalkyl)ethyl potassium sulfates based on perfluorinated Grignard reagents". experimental part. p. 1338 - 1343. Retrieved 2011/02/22.
• 2、 Rubio,Blancou,Commeyras. "-". . p. 1 - 5. Retrieved 2007/10/03.