2-Chloro-alpha-phenyl-3-pyridinemethanol

Base Information

• Chemical Name: 2-Chloro-alpha-phenyl-3-pyridinemethanol
• CAS No.: 80100-23-8
• Molecular Formula: C12H10 Cl N O
• Molecular Weight: 219.671
• DSSTox Substance ID: DTXSID001000964
• Nikkaji Number: J1.039.712J
• Mol file: 80100-23-8.mol

Synonyms:2-Chloro-alpha-phenyl-3-pyridinemethanol;80100-23-8;3-Pyridinemethanol, 2-chloro-alpha-phenyl-;(2-CHLOROPYRIDIN-3-YL)(PHENYL)METHANOL;SCHEMBL10627187;DFZYQRVGTKIAOU-UHFFFAOYSA-N;DTXSID001000964;2-chloro-alpha-phenyl-3-pyridinemetanol;alpha-Phenyl-2-chloropyridine-3-methanol;LS-131691;E79686

Chemical Property of 2-Chloro-alpha-phenyl-3-pyridinemethanol

Chemical Property:

• Vapor Pressure: 1.67E-06mmHg at 25°C
• Boiling Point: 381.6°C at 760 mmHg
• Flash Point: 184.6°C
• PSA: 33.12000
• Density: 1.275g/cm³
• LogP: 2.81670
• XLogP3: 2.6
• Hydrogen Bond Donor Count: 1
• Hydrogen Bond Acceptor Count: 2
• Rotatable Bond Count: 2
• Exact Mass: 219.0450916
• Heavy Atom Count: 15
• Complexity: 194

Purity/Quality:

99%min ^*data from raw suppliers

2-CHLORO-ALPHA-PHENYL-3-PYRIDINEMETHANOL 95.00% ^*data from reagent suppliers

Safty Information:

• Pictogram(s):  
• Hazard Codes: 

MSDS Files:

SDS file from LookChem

Useful:

• Canonical SMILES: C1=CC=C(C=C1)C(C2=C(N=CC=C2)Cl)O

Technology Process of 2-Chloro-alpha-phenyl-3-pyridinemethanol

There total 5 articles about 2-Chloro-alpha-phenyl-3-pyridinemethanol 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: 77.0%

2-chloro-3-carbaldehydepyridine (36404-88-3) + phenylmagnesium bromide (100-58-3) → (2-chloropyridin-3-yl)(phenyl)methanol (80100-23-8)

Guidance literature:

In tetrahydrofuran; diethyl ether; at 20 ℃; for 0.5h; Inert atmosphere;

DOI:10.1016/j.bmcl.2011.12.032

Reference yield: 75.0%

2-chloropyridine (109-09-1) + benzaldehyde (100-52-7) → (2-chloropyridin-3-yl)(phenyl)methanol (80100-23-8)

Guidance literature:

2-chloropyridine; With phenyllithium; diisopropylamine; In tetrahydrofuran; at -40 ℃; for 1h;

benzaldehyde; at -70 ℃; for 0.75h;

DOI:10.1016/S0960-894X(02)00796-5

Reference yield:

3-benzoyl-2-chloro-pyridine (80099-81-6) → (2-chloropyridin-3-yl)(phenyl)methanol (80100-23-8)

Guidance literature:

With sodium borohydrid; In ethanol; water;

upstream raw materials:

2-chloropyridine

benzaldehyde

2-chloro-3-iodopyridine

3-benzoyl-2-chloro-pyridine

Downstream raw materials:

3-benzoyl-2-chloro-pyridine

3-(phenyl-2-chloropyrid-3-ylmethoxy)azetidine

2-chloro-3-[phenyl({1-[(piperidin-1-yl)carbonyl]azetidin-3-yl}oxy)methyl]pyridine

5-phenyl-6,7,8,9-tetrahydrobenzo<1,8>naphthiridine

Refernces

• 1、 Andres, J Ignacio,Alonso, Jose M,Fernandez, Javier,Iturrino, Laura,Martinez, Pedro,Meert, Theo F,Sipido, Victor K. "2-(Dimethylaminomethyl)-tetrahydroisoxazolopyridobenzazepine derivatives. Synthesis of a new 5-HT(2C) antagonist with potential anxiolytic properties.". . p. 3573 - 3577. Retrieved 2007/10/03.
• 2、 Mallet, Marc. "Le phenyl-lithium: nouvel agent de metallation du cycle pyridinique". . p. 49 - 56. Retrieved 2007/10/02.