1-Bromotetradecane

Base Information

• Chemical Name: 1-Bromotetradecane
• CAS No.: 112-71-0
• Deprecated CAS: 1465759-07-2
• Molecular Formula: C14H29Br
• Molecular Weight: 277.288
• Hs Code.: 29033036
• European Community (EC) Number: 203-999-3
• NSC Number: 83468
• UNII: GX615908HN
• DSSTox Substance ID: DTXSID3038725
• Nikkaji Number: J377H
• Wikidata: Q27279335
• ChEMBL ID: CHEMBL3184338
• Mol file: 112-71-0.mol

Synonyms:1-Bromotetradecane;112-71-0;Myristyl bromide;Tetradecyl bromide;Tetradecane, 1-bromo-;n-Tetradecyl bromide;1-Tetradecyl bromide;n-Tetradecyl-1-bromide;Tetradecane, bromo-;C14H29Br;1-bromo tetradecane;1-BroMotetradecane--d4;UNII-GX615908HN;DTXSID3038725;GX615908HN;EINECS 203-999-3;NSC 83468;NSC-83468;bromotetradecane;1-BROMO-N-TETRADECANE;tetradecylbromide;n-tetradecylbromide;1-tetradecylbromide;1-Bromotetradecane, 97%;SCHEMBL139756;C14-H29-Br;CHEMBL3184338;DTXCID1018725;NSC83468;Tox21_202721;BBL010945;MFCD00000228;STK802045;AKOS005622702;CS-W012307;DS-7938;NCGC00260269-01;CAS-112-71-0;B0233;FT-0607549;D70994;EN300-248169;A802635;J-504472;Q27279335

Chemical Property of 1-Bromotetradecane

Chemical Property:

• Appearance/Colour: pale yellow liquid
• Vapor Pressure: 0.00131mmHg at 25°C
• Melting Point: 5-6 °C(lit.)
• Refractive Index: n20/D 1.460(lit.)
• Boiling Point: 307.5 °C at 760 mmHg
• Flash Point: 127.3 °C
• PSA: 0.00000
• Density: 0.93 g/cm³
• LogP: 6.08240
• Storage Temp.: Store below +30°C.
• Solubility.: Chloroform
• Water Solubility.: insoluble
• XLogP3: 8.1
• Hydrogen Bond Donor Count: 0
• Hydrogen Bond Acceptor Count: 0
• Rotatable Bond Count: 12
• Exact Mass: 276.14526
• Heavy Atom Count: 15
• Complexity: 102

Purity/Quality:

99% ^*data from raw suppliers

1-Bromotetradecane ^*data from reagent suppliers

Safty Information:

• Pictogram(s): Xi
• Hazard Codes: Xi
• Statements: 36/37/38-22
• Safety Statements: S24/25:

MSDS Files:

SDS file from LookChem

Useful:

• Chemical Classes: Other Classes -> Halogenated Aliphatics, Saturated
• Canonical SMILES: CCCCCCCCCCCCCCBr
• Uses: 1-Bromotetradecane was used in the synthesis of tetradecylferrocene, cationic and zwitterionic gemini surfactants, and 9-tetradecylcarbazole. Also used for synthesis of metallomesogenic polymers based on bis[η1(N)-3,4-dialkyloxybenzylidene-4?-dodecyloxyaniline]dichloropalladium(II) with octyl, decyl, dodecyl, tetradecyl and hexadecyl alkyl groups.

Technology Process of 1-Bromotetradecane

There total 10 articles about 1-Bromotetradecane 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: 98.0%

1-tetradecene (1120-36-1) → 1-Bromotetradecane (112-71-0)

Guidance literature:

With hydrogen bromide; In 1,4-dioxane; hexane; at 20 ℃; for 1h;

DOI:10.1016/j.tetlet.2017.02.020

Reference yield: 90.0%

1-tetradecene (1120-36-1) → 1-Bromotetradecane (112-71-0) + 2-bromotetradecane (74036-95-6)

Guidance literature:

With acetic acid; In 1,4-dioxane; 1,2-dichloro-ethane;

DOI:10.1016/j.tetlet.2017.02.020

Reference yield: 57.0%

cis-6-tetradecene (41446-61-1) → 1-Bromotetradecane (112-71-0)

Guidance literature:

With bis(1,1,1,5,5,5-hexafluoro-2,4-pentanedionato)palladium(II); chlorotriisopropylsilane; bromoisocyanuric acid monosodium salt; water; lithium perchlorate; C₁₃H₁₆N₂O₂; In dichloromethane; acetonitrile; at 20 ℃; for 6h; regioselective reaction; Schlenk technique; Inert atmosphere; Sealed tube;

DOI:10.1038/s41557-021-00869-x

upstream raw materials:

1-Tetradecanol

methanol

1-Hexadecene

N-tetradecyl-N'-tosylhydrazine

Downstream raw materials:

N-tetradecylpyridinium bromide

2-ethyl-1-tetradecyl-pyridinium; bromide

tetradecylbenzene

(2,4-dinitro-phenyl)-tetradecyl sulfide

Refernces

• 1、 Li, Xiang,Jin, Jianbo,Chen, Pinhong,Liu, Guosheng. "Catalytic remote hydrohalogenation of internal alkenes". . p. 425 - 432. Retrieved 2022/02/07.
• 2、 Wan, Wen,Guang, Wen-Jie,Zhao, Ke-Qin,Zheng, Wei-Zhong,Zhang, Liang-Fu. "Calamitic organometallic liquid crystals with terminal metal. Syntheses and liquid crystal properties of dicarbonylrhodium(I) β-diketonate complexes". . p. 157 - 161. Retrieved 2007/10/03.