1-Bromoheptane-D15

Base Information

• Chemical Name: 1-Bromoheptane-D15
• CAS No.: 98195-42-7
• Molecular Formula: C7Br D15
• Molecular Weight: 194.19
• Mol file: 98195-42-7.mol

Synonyms:Heptyl-d15bromide

Chemical Property of 1-Bromoheptane-D15

Chemical Property:

• PSA: 0.00000
• LogP: 3.35170

Purity/Quality:

95% ^*data from raw suppliers

1-Bromoheptane-d15 ^*data from reagent suppliers

Safty Information:

• Pictogram(s):  
• Hazard Codes: 

MSDS Files:

SDS file from LookChem

Useful:

• Uses: 1-Bromoheptane-d15 is a useful isotopically labeled research compound used in the preparation of perdeuterated carboxylates.

Technology Process of 1-Bromoheptane-D15

There total 7 articles about 1-Bromoheptane-D15 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: 85.1%

heptanol-d16 (158778-86-0,1219804-99-5,194793-95-8) → n-heptyl-d15-bromide (98195-42-7,1219805-66-9)

Guidance literature:

With phosphorus; bromine; at 85 - 90 ℃;

Reference yield:

<(2)H11>Pentyl bromide (126840-21-9,1219803-61-8,148404-92-6) → n-heptyl-d15-bromide (98195-42-7,1219805-66-9)

Guidance literature:

Multi-step reaction with 4 steps

1: 1.) EtONa / 1.) EtOH, 50 deg C, 1 h, 2.) EtOH, 30 deg C, 6 h

2: 1.) D₂O, NaOD, 2.) D₂SO₄ / 1.) reflux, 6 h, 2.) reflux, 4.5 h

3: 90.8 percent / LiAlD₄ / diethyl ether / 8 h / Heating

4: 85.1 percent / red phosphorous, Br₂ / 85 - 90 °C

With phosphorus; lithium aluminium deuteride; deuteriated sodium hydroxide; bromine; water-d2; sodium ethanolate; sulfuric acid-d2; In diethyl ether;

Reference yield:

1-pentanol-d12 (158778-85-9,64118-19-0) → n-heptyl-d15-bromide (98195-42-7,1219805-66-9)

Guidance literature:

Multi-step reaction with 5 steps

1: 83.7 percent / red phosphorous, Br₂ / 85 - 90 °C

2: 1.) EtONa / 1.) EtOH, 50 deg C, 1 h, 2.) EtOH, 30 deg C, 6 h

3: 1.) D₂O, NaOD, 2.) D₂SO₄ / 1.) reflux, 6 h, 2.) reflux, 4.5 h

4: 90.8 percent / LiAlD₄ / diethyl ether / 8 h / Heating

5: 85.1 percent / red phosphorous, Br₂ / 85 - 90 °C

With phosphorus; lithium aluminium deuteride; deuteriated sodium hydroxide; bromine; water-d2; sodium ethanolate; sulfuric acid-d2; In diethyl ether;

upstream raw materials:

heptanol-d16

<(2)H11>Pentyl bromide

1-pentanol-d12

pentanoic acid-d10

Downstream raw materials:

4-n-heptyl-d₁₅-oxyaniline

4,4'-n-bis(heptyl-d₁₅-oxy)azoxybenzene

4-n-heptyl-d15-oxyacetanilide

Refernces