Ethyl 2-bromotetradecanoate

Base Information

• Chemical Name: Ethyl 2-bromotetradecanoate
• CAS No.: 14980-92-8
• Molecular Formula: C16H31BrO2
• Molecular Weight: 335.325
• Hs Code.: 2915900090
• European Community (EC) Number: 239-059-4
• NSC Number: 74506
• DSSTox Substance ID: DTXSID40884780
• Nikkaji Number: J38.903J
• Mol file: 14980-92-8.mol

Synonyms:Ethyl 2-bromotetradecanoate;14980-92-8;Ethyl 2-bromomyristate;Tetradecanoic acid, 2-bromo-, ethyl ester;ETHYL-2-BROMOMYRISTATE;Ethyl alpha-bromomyristate;Ethyl .alpha.-bromomyristate;EINECS 239-059-4;NSC 74506;ethyl -2-bromomyristate;Ethyl2-bromotetradecanoate;ethyl alpha-bromotetradecanoate;ethyl-alpha-bromo-tetradecanoate;SCHEMBL5708286;Ethyl-2-bromo-tetradecanoic acid;DTXSID40884780;NSC74506;Alphabromo-myristic acid ethyl ester;2-bromotetradecanoic acid ethyl ester;MFCD00026594;NSC-74506;AKOS015889164;alpha-Bromotetradecanoic acid ethyl ester;FT-0625941;J-008627

Chemical Property of Ethyl 2-bromotetradecanoate

Chemical Property:

• Vapor Pressure: 6.31E-06mmHg at 25°C
• Refractive Index: n20/D 1.459(lit.)
• Boiling Point: 378.4 °C at 760 mmHg
• Flash Point: 168.7 °C
• PSA: 26.30000
• Density: 1.082 g/cm³
• LogP: 5.62400
• XLogP3: 7.4
• Hydrogen Bond Donor Count: 0
• Hydrogen Bond Acceptor Count: 2
• Rotatable Bond Count: 14
• Exact Mass: 334.15074
• Heavy Atom Count: 19
• Complexity: 207

Purity/Quality:

99% ^*data from raw suppliers

ETHYL 2-BROMOMYRISTATE Aldrich ^*data from reagent suppliers

Safty Information:

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

MSDS Files:

Useful:

• Canonical SMILES: CCCCCCCCCCCCC(C(=O)OCC)Br

Technology Process of Ethyl 2-bromotetradecanoate

There total 5 articles about Ethyl 2-bromotetradecanoate 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: 87.3%

ethanol (64-17-5) + n-tetradecanoic acid (544-63-8) → ethyl 2-bromomyristate (14980-92-8)

Guidance literature:

n-tetradecanoic acid; With thionyl chloride; for 3h; Reflux;

With bromine; iodine; at 85 - 90 ℃; for 1h;

ethanol; In water; for 1h; Reflux;

Reference yield: 72.0%

ethanol (64-17-5) + 2-bromomyristic acid (10520-81-7,201417-53-0,135312-82-2) → ethyl 2-bromomyristate (14980-92-8)

Guidance literature:

With chloro-trimethyl-silane; for 16h; Ambient temperature;

DOI:10.1002/ardp.19963291102

Reference yield:

n-tetradecanoic acid (544-63-8) → ethyl 2-bromomyristate (14980-92-8)

Guidance literature:

With phosphorus; bromine; durch folgende Behandlung mit Aethanol unter Kuehlung;

upstream raw materials:

ethanol

2-bromomyristic acid

n-tetradecanoic acid

tetradecanoyl chloride

Downstream raw materials:

1-Tetradecanol

lauric acid

2-(4-methoxy-phenylsulfanyl)-tetradecanoic acid ethyl ester

dodecyl succinic acid

Refernces

• 1、 Parang, Keykavous,Knaus, Edward E.,Wiebe, Leonard I.,Sardari, Soroush,Daneshtalab, Mohsen,Csizmadia, Ferenc. "Synthesis and antifungal activities of myristic acid analogs". . p. 475 - 482. Retrieved 2007/10/03.