1-Chlorononane

Base Information

• Chemical Name: 1-Chlorononane
• CAS No.: 2473-01-0
• Molecular Formula: C9H19 Cl
• Molecular Weight: 162.703
• Hs Code.: 2903199000
• European Community (EC) Number: 219-595-5
• DSSTox Substance ID: DTXSID3049255
• Nikkaji Number: J1.814G
• Wikidata: Q57907194
• ChEMBL ID: CHEMBL3182251
• Mol file: 2473-01-0.mol

Synonyms:1-CHLORONONANE;2473-01-0;Nonyl chloride;Nonane, 1-chloro-;n-Nonyl chloride;Tetrapropenyl chloride;DTXSID3049255;EINECS 219-595-5;70776-06-6;C9H19Cl;1-chloro-nonane;1-Chlorononane, 98%;SCHEMBL200987;C9-H19-Cl;CHEMBL3182251;DTXCID2029111;SCHEMBL11216574;Tox21_202816;MFCD00001023;STL481901;AKOS009031620;NCGC00260362-01;AS-56921;CAS-2473-01-0;1-Chlorononane, purum, >=96.0% (GC);FT-0607654;EN300-19418;D89217;J-015649;Q57907194

Chemical Property of 1-Chlorononane

Chemical Property:

• Appearance/Colour: CLEAR COLOURLESS LIQUID
• Vapor Pressure: 0.394mmHg at 25°C
• Melting Point: -39.4°C
• Refractive Index: n20/D 1.436(lit.)
• Boiling Point: 202-204 °C(lit.)
• Flash Point: 166 °F
• PSA: 0.00000
• Density: 0.87 g/mL at 25 °C(lit.)
• LogP: 3.97580
• Storage Temp.: Store below +30°C.
• XLogP3: 5.2
• Hydrogen Bond Donor Count: 0
• Hydrogen Bond Acceptor Count: 0
• Rotatable Bond Count: 7
• Exact Mass: 162.1175283
• Heavy Atom Count: 10
• Complexity: 52.7

Purity/Quality:

98%,99%, ^*data from raw suppliers

1-Chlorononane ^*data from reagent suppliers

Safty Information:

• Pictogram(s): Xi
• Hazard Codes: Xi
• Statements: 36/37/38
• Safety Statements: 26-36/37/39

MSDS Files:

SDS file from LookChem

Useful:

• Canonical SMILES: CCCCCCCCCCl
• Uses: 1-Chlorononane has been used in the synthesis of 2-bromo[1-14C]1-decanal, affinity labeling probe for the aliphatic aldehyde site of Vibrio harveyi luciferase.

Technology Process of 1-Chlorononane

There total 32 articles about 1-Chlorononane 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: 93.0%

1,4-dinonylpiperazine (82394-19-2) → 1-Chlorononane (2473-01-0)

Guidance literature:

With phenyl chloroformate; In benzene; Heating;

DOI:10.1016/S0040-4039(00)95746-0

Reference yield: 91.0%

4-chlorobutyl bromide (6940-78-9) + pentylmagnesium chloride (6393-56-2) → 1-Chlorononane (2473-01-0)

Guidance literature:

With [((Me)NN₂)NiCl]; In tetrahydrofuran; ISOPROPYLAMIDE; at -35 - 20 ℃; Inert atmosphere;

Reference yield: 90.5%

(3Z,6Z)-1-chloro-3,6-nonadiene (1455183-96-6) → 1-Chlorononane (2473-01-0)

Guidance literature:

With sodium tetrahydroborate; hydrogen; nickel diacetate; zinc(II) oxide; In isopropyl alcohol; at 35 - 55 ℃; for 21.5h;

upstream raw materials:

nonane

nonyl alcohol

1-iodononane

1,1,1,9-tetrachloro-nonane

Downstream raw materials:

n-nonyl fluoride

n-Nonylamin

nonyl alcohol

benzyl-nonyl sulfide

Refernces

• 1、 André-Joyaux, Emy,Kuzovlev, Andrey,Renaud, Philippe,Tappin, Nicholas D. C.. "A General Approach to Deboronative Radical Chain Reactions with Pinacol Alkylboronic Esters". supporting information. p. 13859 - 13864. Retrieved 2020/06/10.
• 2、 Munyemana, Fran?ois,George, Isabelle,Devos, Alain,Colens, Alain,Badarau, Eduard,Frisque-Hesbain, Anne-Marie,Loudet, Aurore,Differding, Edmond,Damien, Jean-Marie,Rémion, Jeanine,Van Uytbergen, Jacqueline,Ghosez, Léon. "A mild method for the replacement of a hydroxyl group by halogen. 1. Scope and chemoselectivity". . p. 420 - 430. Retrieved 2015/12/31.