Benzaldehyde, 2-[(5-bromopentyl)oxy]-

Base Information

• Chemical Name: Benzaldehyde, 2-[(5-bromopentyl)oxy]-
• CAS No.: 102684-67-3
• Molecular Formula: C12H15BrO2
• Molecular Weight: 271.154
• DSSTox Substance ID: DTXSID10548923
• Wikidata: Q82427781
• Mol file: 102684-67-3.mol

Synonyms:Benzaldehyde, 2-[(5-bromopentyl)oxy]-;102684-67-3;2-(5-bromopentoxy)benzaldehyde;2-(5-BROMO-PENTYLOXY)-BENZALDEHYDE;SCHEMBL10482275;2-(5-bromopentyloxy)benzaldehyde;DTXSID10548923;MNYOBCBZESZCBI-UHFFFAOYSA-N;2-[(5-BROMOPENTYL)OXY]BENZALDEHYDE

Chemical Property of Benzaldehyde, 2-[(5-bromopentyl)oxy]-

Chemical Property:

• XLogP3: 3.5
• Hydrogen Bond Donor Count: 0
• Hydrogen Bond Acceptor Count: 2
• Rotatable Bond Count: 7
• Exact Mass: 270.02554
• Heavy Atom Count: 15
• Complexity: 173

Purity/Quality:

Safty Information:

• Pictogram(s):  
• Hazard Codes: 

MSDS Files:

SDS file from LookChem

Useful:

• Canonical SMILES: C1=CC=C(C(=C1)C=O)OCCCCCBr

Technology Process of Benzaldehyde, 2-[(5-bromopentyl)oxy]-

There total 3 articles about Benzaldehyde, 2-[(5-bromopentyl)oxy]- 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: 87.0%

1,5-dibromo-pentane (111-24-0) + salicylaldehyde (90-02-8) → 2-<(5-bromopentyl)oxy>benzaldehyde (102684-67-3)

Guidance literature:

salicylaldehyde; With potassium carbonate; In N,N-dimethyl-formamide; at 20 ℃; for 0.166667h;

1,5-dibromo-pentane; In N,N-dimethyl-formamide; at 20 ℃; for 72h;

DOI:10.1002/chem.202102493

Reference yield: 72.0%

salicylaldehyde (90-02-8) + Toluene-4-sulfonic acid 5-bromo-pentyl ester (114258-54-7) → 2-<(5-bromopentyl)oxy>benzaldehyde (102684-67-3)

Guidance literature:

With potassium carbonate; In N,N-dimethyl-formamide; for 68h; Ambient temperature;

DOI:10.1248/cpb.35.2394

Reference yield:

1,5-dibromo-pentane (111-24-0) + 2-methyl-benzyl alcohol (89-95-2) → 2-<(5-bromopentyl)oxy>benzaldehyde (102684-67-3)

Guidance literature:

In N,N-dimethyl-formamide;

DOI:10.1021/jo060594+

upstream raw materials:

1,5-dibromo-pentane

salicylaldehyde

Toluene-4-sulfonic acid 5-bromo-pentyl ester

2-methyl-benzyl alcohol

Downstream raw materials:

2-[5-(4-Phenyl-piperazin-1-yl)-pentyloxy]-benzaldehyde

2-{2-[5-(4-Phenyl-piperazin-1-yl)-pentyloxy]-phenyl}-thiazolidine-3-carbothioic acid methylamide

2-(5-bromopentyloxy)benzaldehyde ethylene acetal

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