OTAVA-BB 1364598

Base Information

• Chemical Name: OTAVA-BB 1364598
• CAS No.: 294647-97-5
• Molecular Formula: C12H12N2
• Molecular Weight: 184.241
• Hs Code.: 2933399090
• Mol file: 294647-97-5.mol

Synonyms:4-(2-Pyridinyl)-benzenemethanamine;OTAVA-BB 1364598;(4-(pyridin-2-yl)phenyl)methanamine;

Chemical Property of OTAVA-BB 1364598

Chemical Property:

• Boiling Point: 346.9 °C at 760 mmHg
• Flash Point: 184.3 °C
• PSA: 38.91000
• Density: 1.097 g/cm³
• LogP: 2.90760
• Storage Temp.: under inert gas (nitrogen or Argon) at 2–8 °C

Purity/Quality:

98%min ^*data from raw suppliers

(4-(Pyridin-2-yl)phenyl)methanamine ^*data from reagent suppliers

Safty Information:

• Pictogram(s):  
• Hazard Codes: 

MSDS Files:

SDS file from LookChem

Useful:

Technology Process of OTAVA-BB 1364598

There total 4 articles about OTAVA-BB 1364598 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-(pyridine-2-yl)benzonitrile (32111-34-5) → 1-[4-(pyridin-2-yl)phenyl]methanamine (294647-97-5)

Guidance literature:

With lithium aluminium tetrahydride; In tetrahydrofuran; at 60 ℃; for 5h;

DOI:10.1021/acs.jmedchem.5b01884

Reference yield:

2-bromo-pyridine (109-04-6) → 1-[4-(pyridin-2-yl)phenyl]methanamine (294647-97-5)

Guidance literature:

Multi-step reaction with 2 steps

1: Pd(OAc)2; Ph₃P; K₂CO₃ / tetrahydrofuran

2: NH₃; H₂ / RaNi / methanol

With palladium diacetate; ammonia; hydrogen; potassium carbonate; triphenylphosphine; RaNi; In tetrahydrofuran; methanol; 1: Suzuki coupling;

DOI:10.1016/j.bmcl.2005.05.133

Reference yield:

4-cyanophenylboronic acid (126747-14-6) → 1-[4-(pyridin-2-yl)phenyl]methanamine (294647-97-5)

Guidance literature:

Multi-step reaction with 2 steps

1: Pd(OAc)2; Ph₃P; K₂CO₃ / tetrahydrofuran

2: NH₃; H₂ / RaNi / methanol

With palladium diacetate; ammonia; hydrogen; potassium carbonate; triphenylphosphine; RaNi; In tetrahydrofuran; methanol; 1: Suzuki coupling;

DOI:10.1016/j.bmcl.2005.05.133

upstream raw materials:

4-(pyridine-2-yl)benzonitrile

2-bromo-pyridine

4-cyanophenylboronic acid

Downstream raw materials:

2-chloro-6-[4-(2-pyridyl)phenylmethylamino]purine

2-chloro-6-[4-(2-pyridyl)phenylmethylamino]-purine

C₂₆H₃₂N₈

2-chloro-9-isopropyl-N-[[4-(2-pyridyl)phenyl]methyl]purin-6-amine

Refernces

• 1、 -. "Purinenucleoside derivative modified in 8-position and medical use thereof". Page/Page column 27. . Retrieved 2010/11/28.
• 2、 -. "PYRAZOLOPYRIMIDINES AS CYCLIN-DEPENDENT KINASE INHIBITORS". Page 98-99. . Retrieved 2008/06/13.