1-(2-Chlorophenyl)-1-phenyl-2-propyn-1-ol

Base Information

• Chemical Name: 1-(2-Chlorophenyl)-1-phenyl-2-propyn-1-ol
• CAS No.: 13732-87-1
• Molecular Formula: C15H11ClO
• Molecular Weight: 242.70000
• DSSTox Substance ID: DTXSID701268913
• Nikkaji Number: J1.742.284G
• Mol file: 13732-87-1.mol

Synonyms:SCHEMBL9067519;DTXSID701268913;1-(2-chlorophenyl)-1-phenyl-2-propyn-1-ol;1-(2-chlorophenyl)-1-phenylprop-2-yn-1-ol;1-Phenyl-1-(2-chlorophenyl)-2-propyne-1-ol;2-Chloro-alpha-ethynyl-alpha-phenylbenzenemethanol;13732-87-1

Chemical Property of 1-(2-Chlorophenyl)-1-phenyl-2-propyn-1-ol

Chemical Property:

• PSA: 20.23000
• LogP: 3.20910
• XLogP3: 3.5
• Hydrogen Bond Donor Count: 1
• Hydrogen Bond Acceptor Count: 1
• Rotatable Bond Count: 3
• Exact Mass: 242.0498427
• Heavy Atom Count: 17
• Complexity: 299

Purity/Quality:

Safty Information:

• Pictogram(s):  
• Hazard Codes: 

MSDS Files:

SDS file from LookChem

Useful:

• Canonical SMILES: C#CC(C1=CC=CC=C1)(C2=CC=CC=C2Cl)O

Technology Process of 1-(2-Chlorophenyl)-1-phenyl-2-propyn-1-ol

There total 5 articles about 1-(2-Chlorophenyl)-1-phenyl-2-propyn-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: 88.0%

(2-chlorophenyl)(phenyl)methanone (5162-03-8) + acetylenemagnesium bromide (4301-14-8) → (-)-1-phenyl-1-(o-chlorophenyl)-2-propyn-1-ol (13732-87-1)

Guidance literature:

In tetrahydrofuran; for 16h; Heating;

DOI:10.1039/b308410h

Reference yield:

(7S,7aS,14S,14aR)-Dodecahydro-7,14-methano-dipyrido[1,2-a;1',2'-e][1,5]diazocine; compound with (R)-1-(2-chloro-phenyl)-1-phenyl-prop-2-yn-1-ol → (R)-(-)-phenyl-1-(o-chlorophenyl)prop-2-yn-1-ol (13732-87-1,86436-15-9,86436-16-0,87988-90-7)

Guidance literature:

With hydrogenchloride;

DOI:10.1039/c39830000743

Reference yield:

(2-chlorophenyl)(phenyl)methanone (5162-03-8) + acetylene (74-86-2,25067-58-7) → (-)-1-phenyl-1-(o-chlorophenyl)-2-propyn-1-ol (13732-87-1)

Guidance literature:

With tetrahydrofuran; potassium hydroxide;

upstream raw materials:

(2-chlorophenyl)(phenyl)methanone

acetylene

acetylenemagnesium bromide

Downstream raw materials:

(Z)-3-(2-Chloro-phenyl)-3-phenyl-propenal

(E)-3-(2-Chloro-phenyl)-3-phenyl-propenal

(-)-1,6-diphenyl-1,6-di(o-chlorophenyl)-2,4-hexadiyne-1,6-diol

(R)-(-)-phenyl-1-(o-chlorophenyl)prop-2-yn-1-ol