1-(2-Chlorophenyl)butan-1-ol

Base Information

• Chemical Name: 1-(2-Chlorophenyl)butan-1-ol
• CAS No.: 5434-55-9
• Molecular Formula: C10H13ClO
• Molecular Weight: 184.6626
• NSC Number: 15670
• DSSTox Substance ID: DTXSID50280138

Synonyms:1-(2-chlorophenyl)butan-1-ol;5434-55-9;NSC15670;p-chloro-a-propylbenzylalcohol;SCHEMBL5693670;DTXSID50280138;NSC 15670;NSC-15670;AKOS010258815;CS-0225927;FT-0752495;EN300-1252525;Z733415366

Chemical Property of 1-(2-Chlorophenyl)butan-1-ol

Chemical Property:

• Vapor Pressure: 0.0043mmHg at 25°C
• Boiling Point: 266.5°Cat760mmHg
• Flash Point: 115°C
• Density: 1.115g/cm³
• XLogP3: 2.9
• Hydrogen Bond Donor Count: 1
• Hydrogen Bond Acceptor Count: 1
• Rotatable Bond Count: 3
• Exact Mass: 184.0654927
• Heavy Atom Count: 12
• Complexity: 127

Purity/Quality:

99% ^*data from raw suppliers

Safty Information:

• Pictogram(s):  
• Hazard Codes: 

MSDS Files:

SDS file from LookChem

Useful:

• Canonical SMILES: CCCC(C1=CC=CC=C1Cl)O

Technology Process of 1-(2-Chlorophenyl)butan-1-ol

There total 3 articles about 1-(2-Chlorophenyl)butan-1-ol 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: 46.0%

(2-chloro-phenyl)-trimethyl-silane (15842-76-9) + butyraldehyde (123-72-8) → 1-(2-chlorphenyl)-1-butanol (5434-55-9)

Guidance literature:

potassium fluoride; In N,N,N,N,N,N-hexamethylphosphoric triamide; at 80 ℃; for 12h;

Reference yield:

(2-Chlorphenyl)-propylketon (21550-07-2) → 1-(2-chlorphenyl)-1-butanol (5434-55-9)

Guidance literature:

With platinum; Hydrogenation;

DOI:10.1021/ja01129a004

Reference yield:

n-propylmagnesium bromide (927-77-5) + 2-chloro-benzaldehyde (89-98-5) → 1-(2-chlorphenyl)-1-butanol (5434-55-9)

Guidance literature:

DOI:10.1021/ja01598a031

upstream raw materials:

(2-Chlorphenyl)-propylketon

n-propylmagnesium bromide

2-chloro-benzaldehyde

(2-chloro-phenyl)-trimethyl-silane

Downstream raw materials:

1-butyl-2-chlorobenzene

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