1-Iodononane

Base Information

• Chemical Name: 1-Iodononane
• CAS No.: 4282-42-2
• Molecular Formula: C9H19I
• Molecular Weight: 254.154
• Hs Code.: 29033990
• European Community (EC) Number: 224-286-3
• NSC Number: 5520
• UNII: V528UR3HZE
• DSSTox Substance ID: DTXSID6049301
• Nikkaji Number: J47.980B
• Wikidata: Q69758045
• ChEMBL ID: CHEMBL3184063
• Mol file: 4282-42-2.mol

Synonyms:1-Iodononane;4282-42-2;Nonyl iodide;n-Nonyl iodide;Nonane, 1-iodo-;1-n-Nonyl iodide;V528UR3HZE;DTXSID6049301;NSC 5520;NSC-5520;EINECS 224-286-3;1-Iodononane (Stabilized with Copper);IODONONANE;C9H19I;1-iodo-n-nonane;1-Iodononane, 95%;UNII-V528UR3HZE;SCHEMBL873434;CHEMBL3184063;DTXCID8029157;NSC5520;Nonyl iodide (stabilzed over Cu);1-Iodononane (stabilized over Cu);C9-H19-I;Tox21_202833;BBL011365;MFCD00001107;STL146462;AKOS005720905;NCGC00260379-01;AS-56404;CAS-4282-42-2;CS-0179369;FT-0607966;I0493;EN300-19869;D91171;A826017;J-802258;6683-07-4

Chemical Property of 1-Iodononane

Chemical Property:

• Vapor Pressure: 0.0453mmHg at 25°C
• Melting Point: -20°C
• Refractive Index: 1.486-1.488
• Boiling Point: 245.316 °C at 760 mmHg
• Flash Point: 85 °C
• Density: 1.297 g/cm³
• Storage Temp.: Refrigerator
• Sensitive.: Light Sensitive
• Solubility.: Chloroform, Methanol
• Water Solubility.: insoluble
• XLogP3: 5.8
• Hydrogen Bond Donor Count: 0
• Hydrogen Bond Acceptor Count: 0
• Rotatable Bond Count: 7
• Exact Mass: 254.05315
• Heavy Atom Count: 10
• Complexity: 52.7

Purity/Quality:

98% ^*data from raw suppliers

1-Iodononane(StabilizedwithCopper) ^*data from reagent suppliers

Safty Information:

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

MSDS Files:

Total 1 MSDS from other Authors

Useful:

• Canonical SMILES: CCCCCCCCCI
• Uses: 1-Iodononane is a reagent used in the synthesis of antimicrobial imidazo[1,5-a]quinoxaline derivatives. Also used in the synthesis of serotonin transporter inhibitors as antidepressants. 1-Iodononane has been used in the synthesis of:Sch II, a cerebroside that induces fruiting body formation in the basidiomycete Schizophyllum commune2,6-dimethyl-4-nonylpyridine2-tridecanone

Technology Process of 1-Iodononane

There total 8 articles about 1-Iodononane 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: 90.0%

1-decanoic acid (334-48-5) → 1-iodononane (4282-42-2)

Guidance literature:

With N-iodo-succinimide; iodine; In 1,2-dichloro-ethane; at 100 ℃; for 8h; Sealed tube; Darkness;

DOI:10.1002/ejoc.201501315

Reference yield: 43.0%

2-(1-nonyloxy)-1-ethanol (16979-32-1) → 1-iodononane (4282-42-2) + nonyl alcohol (143-08-8)

Guidance literature:

With Methyltrichlorosilane; sodium iodide; In acetonitrile; at 25 ℃; for 36h;

DOI:10.1021/jo00169a010

Reference yield: 43.0%

2-(1-nonyloxy)-1-ethanol (16979-32-1) → ethanol (64-17-5) + 1-iodononane (4282-42-2) + ethyl iodide (75-03-6) + nonyl alcohol (143-08-8)

Guidance literature:

With Methyltrichlorosilane; sodium iodide; In acetonitrile; at 25 ℃; for 36h;

upstream raw materials:

nonyl alcohol

nitric acid nonyl ester

2-(1-nonyloxy)-1-ethanol

non-1-ene

Downstream raw materials:

1-nonyl piperazine

n-nonyl-n-methylamine

N-methyl-N-nonylnonan-1-amine

nonyl 3-phenyldithiocarbazate

Refernces

• 1、 Wang, Chao,Lei, Yingjie,Guo, Mengzhun,Shang, Qinyu,Liu, Hong,Xu, Zhaoqing,Wang, Rui. "Photoinduced, Copper-Promoted Regio- and Stereoselective Decarboxylative Alkylation of α,β-Unsaturated Acids with Alkyl Iodides". supporting information. p. 6412 - 6415. Retrieved 2017/12/08.
• 2、 Shono,Chuankamnerdkarn,Maekawa,Ishifune,Kashimura. "Electroorganic chemistry; 145: Coupling reaction of an olefin with a radical NO.3 generated by anodic oxidation of NO-3". . p. 895 - 897. Retrieved 2007/10/02.