4-(3-Bromopropoxy)benzaldehyde

Base Information

• Chemical Name: 4-(3-Bromopropoxy)benzaldehyde
• CAS No.: 17954-81-3
• Molecular Formula: C10H11BrO2
• Molecular Weight: 243.1
• Hs Code.: 2913000090
• DSSTox Substance ID: DTXSID10547456
• Nikkaji Number: J2.316.622D
• Wikidata: Q82425690
• Mol file: 17954-81-3.mol

Synonyms:4-(3-Bromopropoxy)benzaldehyde;17954-81-3;SCHEMBL586117;4(3-bromopropyloxy)benzaldehyde;4-(3-Bromopropyloxy)benzaldehyde;DTXSID10547456;XQCCNZFHLCQXEP-UHFFFAOYSA-N;MFCD08447768;AKOS000101908;CS-0448688

Chemical Property of 4-(3-Bromopropoxy)benzaldehyde

Chemical Property:

• Vapor Pressure: 0mmHg at 25°C
• Boiling Point: 351.343oC at 760 mmHg
• Flash Point: 166.287oC
• PSA: 26.30000
• Density: 1.419g/cm3
• LogP: 2.66290
• XLogP3: 2.5
• Hydrogen Bond Donor Count: 0
• Hydrogen Bond Acceptor Count: 2
• Rotatable Bond Count: 5
• Exact Mass: 241.99424
• Heavy Atom Count: 13
• Complexity: 142

Purity/Quality:

99%, ^*data from raw suppliers

4-(3-Bromopropoxy)benzaldehyde 97% ^*data from reagent suppliers

Safty Information:

• Pictogram(s):  
• Hazard Codes: 

MSDS Files:

Useful:

• Canonical SMILES: C1=CC(=CC=C1C=O)OCCCBr

Technology Process of 4-(3-Bromopropoxy)benzaldehyde

There total 8 articles about 4-(3-Bromopropoxy)benzaldehyde 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: 91.0%

4-hydroxy-benzaldehyde (123-08-0,65581-83-1) + 1,3-dibromo-propane (109-64-8) → 4-(3-bromopropoxy)benzaldehyde (17954-81-3)

Guidance literature:

With potassium carbonate; In N,N-dimethyl-formamide; at 80 ℃; for 1h;

DOI:10.1016/j.ejmech.2021.113870

Reference yield: 89.0%

→ 4-(3-bromopropoxy)benzaldehyde (17954-81-3)

Guidance literature:

Reference yield: 88.0%

4-(3-Bromopropoxy)benzonitrile (37136-86-0) → 4-(3-bromopropoxy)benzaldehyde (17954-81-3)

Guidance literature:

With sodium hydride; zinc(II) chloride; In tetrahydrofuran; mineral oil; at 40 ℃; for 3h; Inert atmosphere; Sealed tube;

DOI:10.1055/s-0039-1690838

upstream raw materials:

4-hydroxy-benzaldehyde

1,3-dibromo-propane

1-bromo-3-propanol

1.3-chlorobromopropane

Downstream raw materials:

p-(3-hydroxypropyl)-benzaldehyde

4-propoxybenzaldehyde

5,15-bis-[4-(3-bromo-propoxy)-phenyl]-2,8,12,18-tetraethyl-3,7,13,17-tetramethyl-porphyrinogene

4-[3-(biphenyl-4-yloxy)-propoxy]-benzaldehyde