7-(Bromomethyl)pentadecane

Base Information

• Chemical Name: 7-(Bromomethyl)pentadecane
• CAS No.: 52997-43-0
• Deprecated CAS: 2117096-90-7
• Molecular Formula: C16H33Br
• Molecular Weight: 305.342
• Hs Code.: 2903399090
• DSSTox Substance ID: DTXSID30866292
• Nikkaji Number: J3.226.969I
• Mol file: 52997-43-0.mol

Synonyms:7-(bromomethyl)pentadecane;52997-43-0;1-Bromo-2-hexyldecane;Pentadecane, 7-(bromomethyl)-;MFCD00136231;2-hexyldecylbromide;2-Hexyldecyl bromide;Bromomethyl)pentadecane;7-bromomethyl-pentadecane;SCHEMBL324583;DTXSID30866292;AMY28804;CCA99743;AKOS015843127;DS-4316;SY055275;DB-005701;B4544;CS-0138077;EN300-7400983;A829339

Chemical Property of 7-(Bromomethyl)pentadecane

Chemical Property:

• Vapor Pressure: 0.000163mmHg at 25°C
• Refractive Index: 1.459
• Boiling Point: 341.1 °C at 760 mmHg
• Flash Point: 107.6 °C
• PSA: 0.00000
• Density: 0.997 g/cm³
• LogP: 6.71850
• Storage Temp.: Keep in dark place,Sealed in dry,Room Temperature
• XLogP3: 8.4
• Hydrogen Bond Donor Count: 0
• Hydrogen Bond Acceptor Count: 0
• Rotatable Bond Count: 13
• Exact Mass: 304.17656
• Heavy Atom Count: 17
• Complexity: 134

Purity/Quality:

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

7-(Bromomethyl)pentadecane >95.0%(GC) ^*data from reagent suppliers

Safty Information:

• Pictogram(s):  
• Hazard Codes: 

MSDS Files:

SDS file from LookChem

Useful:

• Canonical SMILES: CCCCCCCCC(CCCCCC)CBr

Technology Process of 7-(Bromomethyl)pentadecane

There total 8 articles about 7-(Bromomethyl)pentadecane 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: 97.0%

2-hexyldecan-1-ol (2425-77-6) → 7-(bromomethyl)pentadecane (52997-43-0)

Guidance literature:

With bromine; triphenylphosphine; In dichloromethane; at 20 ℃; Inert atmosphere;

DOI:10.1039/c7tc03959j

Reference yield: 95.0%

→ 7-(bromomethyl)pentadecane (52997-43-0)

Guidance literature:

With tetrabutylammomium bromide; In 2-methyltetrahydrofuran; at 80 ℃; for 0.666667h;

Reference yield:

2-hexyldecanoic acid (25354-97-6) → 7-(bromomethyl)pentadecane (52997-43-0)

Guidance literature:

Multi-step reaction with 3 steps

1: 95 percent / diethyl ether

2: 82 percent / LAH / tetrahydrofuran / 3 h / Heating

3: 95.7 percent / 48percent aq. HBr / 4 h / Heating

With lithium aluminium tetrahydride; hydrogen bromide; In tetrahydrofuran; diethyl ether;

upstream raw materials:

2-hexyldecan-1-ol

diethyl 2-hexylmalonate

1-bromo-hexane

2-hexyldecanoic acid

Downstream raw materials:

3,6-bis(5-bromothien-2-yl)-2,5-bis(2-hexyldecyl)pyrrolo[3,4-c]pyrrole-1,4(2H,5H)-dione

7-methyleneheptadecane

2-hexyldecanal

(E)-1-(2-(2-hexyldecyloxy)-6-hydroxyphenyl)-3-(4-(methoxymethoxy)phenyl)prop-2-en-1-one

Refernces

• 1、 Ide, Marina,Saeki, Akinori,Koizumi, Yoshiko,Koganezawa, Tomoyuki,Seki, Shu. "Molecular engineering of benzothienoisoindigo copolymers allowing highly preferential face-on orientations". . p. 21578 - 21585. Retrieved 2015.
• 2、 Guo, Xugang,Ortiz, Rocio Ponce,Zheng, Yan,Kim, Myung-Gil,Zhang, Shiming,Hu, Yan,Lu, Gang,Facchetti, Antonio,Marks, Tobin J.. "Thieno[3,4- c ]pyrrole-4,6-dione-based polymer semiconductors: Toward high-performance, air-stable organic thin-film transistors". . p. 13685 - 13697. Retrieved 2011.
• 3、 Harris, Jared D.,Stihl, Markus,Schmidt, Hans-Werner,Carter, Kenneth R.. "Dithienobenzimidazole-containing conjugated donor–acceptor polymers: Synthesis and characterization". . p. 60 - 69. Retrieved 2019/01/03.
• 4、 Conboy, Gary,Taylor, Rupert G. D.,Findlay, Neil J.,Kanibolotsky, Alexander L.,Inigo, Anto R.,Ghosh, Sanjay S.,Ebenhoch, Bernd,Krishnan Jagadamma, Lethy,Thalluri, Gopala Krishna V. V.,Sajjad, Muhammad T.,Samuel, Ifor D. W.,Skabara, Peter J.. "Novel 4,8-benzobisthiazole copolymers and their field-effect transistor and photovoltaic applications". supporting information. p. 11927 - 11936. Retrieved 2017/11/30.