Ethyl 2-bromohexanoate, (R)-

Base Information

• Chemical Name: Ethyl 2-bromohexanoate, (R)-
• CAS No.: 124439-30-1
• Molecular Formula: C8H15BrO2
• Molecular Weight: 223.11
• UNII: UE2060FOH0
• Nikkaji Number: J275.586F
• Wikidata: Q27291035
• Mol file: 124439-30-1.mol

Synonyms:Ethyl 2-bromohexanoate, (R)-;UNII-UE2060FOH0;Hexanoic acid, 2-bromo-, ethyl ester, (R)-;UE2060FOH0;124439-30-1;(2R)-2-bromohexanoic acid ethyl ester;(R)-ethyl 2-bromohexanoate;SCHEMBL7353073;ethyl (2R)-2-bromanylhexanoate;A833317;Q27291035

Chemical Property of Ethyl 2-bromohexanoate, (R)-

Chemical Property:

• XLogP3: 3.1
• Hydrogen Bond Donor Count: 0
• Hydrogen Bond Acceptor Count: 2
• Rotatable Bond Count: 6
• Exact Mass: 222.02554
• Heavy Atom Count: 11
• Complexity: 115

Purity/Quality:

99.90% ^*data from raw suppliers

Safty Information:

• Pictogram(s):  
• Hazard Codes: 

MSDS Files:

SDS file from LookChem

Useful:

• Canonical SMILES: CCCCC(C(=O)OCC)Br
• Isomeric SMILES: CCCC[C@H](C(=O)OCC)Br

Technology Process of Ethyl 2-bromohexanoate, (R)-

There total 1 articles about Ethyl 2-bromohexanoate, (R)- 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:

Ethyl 2-bromohexanoate (615-96-3) → (R)-(+)-2-bromohexanoic acid (616-05-7,2681-83-6,91423-84-6,91423-83-5) + (2S)-2-bromohexanoic acid (91423-84-6) + ethyl (2R)-2-bromohexanoate (124439-30-1) + (S)-2-Bromo-hexanoic acid ethyl ester (171598-11-1)

Guidance literature:

With water; Pseudomonas lipase enzyme; Yield given. Yields of byproduct given. Title compound not separated from byproducts; Ambient temperature; 0.05 M aq, phosphate buffer ( pH 7.0);

DOI:10.1021/jo00290a007

Reference yield:

ethyl (2R)-2-bromohexanoate (124439-30-1) + 4-(1,3-dioxabutyl)piperidine amide of L-phenylalanine (141047-59-8) → (S)-2-[(S)-1-Benzyl-2-(4-methoxymethoxy-piperidin-1-yl)-2-oxo-ethylamino]-hexanoic acid ethyl ester (141047-67-8)

Guidance literature:

With ammonium carbonate; In nitromethane; water; at 48 ℃; for 72h;

DOI:10.1021/jm00088a006

upstream raw materials:

Ethyl 2-bromohexanoate

Downstream raw materials:

(S)-2-[(S)-1-Benzyl-2-(4-methoxymethoxy-piperidin-1-yl)-2-oxo-ethylamino]-hexanoic acid ethyl ester

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