1-Iodoundecane

Base Information

• Chemical Name: 1-Iodoundecane
• CAS No.: 4282-44-4
• Deprecated CAS: 146846-81-3
• Molecular Formula: C11H23I
• Molecular Weight: 282.208
• Hs Code.: 2903399090
• DSSTox Substance ID: DTXSID7063394
• Nikkaji Number: J421.717I
• Wikidata: Q81990709
• Mol file: 4282-44-4.mol

Synonyms:1-IODOUNDECANE;4282-44-4;Undecane, 1-iodo-;AI3-23975;iodoundecane;1-iodo-n-undecane;undecyl iodide;1-iodo-undecane;C11H23I;1-Iodoundecane, 98%;SCHEMBL1377708;DTXSID7063394;C11-H23-I;MFCD00001087;AKOS015912906;1-Iodoundecane, stabilized with copper;AS-56586;CS-0204750;FT-0607974

Chemical Property of 1-Iodoundecane

Chemical Property:

• Appearance/Colour: clear colourless liquid
• Vapor Pressure: 0.00589mmHg at 25°C
• Melting Point: 2°C
• Refractive Index: n20/D 1.4849(lit.)
• Boiling Point: 282 °C at 760 mmHg
• Flash Point: 106.6 °C
• PSA: 0.00000
• Density: 1.232 g/cm³
• LogP: 4.95220
• Sensitive.: Light Sensitive
• XLogP3: 6.9
• Hydrogen Bond Donor Count: 0
• Hydrogen Bond Acceptor Count: 0
• Rotatable Bond Count: 9
• Exact Mass: 282.08445
• Heavy Atom Count: 12
• Complexity: 71.4

Purity/Quality:

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

1-Iodoundecane ^*data from reagent suppliers

Safty Information:

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

MSDS Files:

SDS file from LookChem

Total 1 MSDS from other Authors

Useful:

• Canonical SMILES: CCCCCCCCCCCI
• Uses: 1-Iodoundecane (cas# 4282-44-4) is a compound useful in organic synthesis.

Technology Process of 1-Iodoundecane

There total 26 articles about 1-Iodoundecane 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: 88.0%

Undecyltellanyl-benzene (81609-28-1) → 1-iodo-n-undecane (4282-44-4)

Guidance literature:

With sodium iodide; methyl iodide; In N,N-dimethyl-formamide; at 55 ℃;

DOI:10.1246/cl.1982.1081

Reference yield: 75.0%

2,3-dimethyl-2-(1-methoxydodecyl)peroxybut-3-ene (222190-76-3) → 1-iodo-n-undecane (4282-44-4)

Guidance literature:

With triethyl borane; oxygen; ethyl iodoacetae; In hexane; cyclohexane; at 20 ℃;

DOI:10.1021/jo9918495

Reference yield: 71.0%

undecyl alcohol (112-42-5) → 1-iodo-n-undecane (4282-44-4)

Guidance literature:

With methanesulfonic acid; sodium iodide; In dichloromethane; for 8h; Heating;

DOI:10.1081/SCC-100103316

upstream raw materials:

undecyl alcohol

bromoundecane

Iododecane

(phenylthio)methyllithium

Downstream raw materials:

1-tetradecene

1-fluoroundecane

1-undecene

1-(Dodecane-1-sulfinyl)-1-methylsulfanyl-cyclohexane

Refernces

• 1、 Donnard, Morgan,Guérin, Thomas,Hanquet, Gilles,Leroux, Frédéric R.,Panossian, Armen,Saiter, Jérémy. "Direct Trifluoromethoxylation without OCF3-Carrier through In Situ Generation of Fluorophosgene". supporting information. p. 3139 - 3147. Retrieved 2021/06/26.
• 2、 Kamal, Ahmed,Ramesh,Laxman. "New halogenation reagent system for one-pot conversion of alcohols into iodides and azides". . p. 827 - 833. Retrieved 2007/10/03.