1-(Pyridin-3-yl)propan-2-amine

Base Information

• Chemical Name: 1-(Pyridin-3-yl)propan-2-amine
• CAS No.: 71271-61-9
• Molecular Formula: C8H12N2
• Molecular Weight: 136.197
• Hs Code.: 2933399090
• ChEMBL ID: CHEMBL4533731
• DSSTox Substance ID: DTXSID40405712
• Mol file: 71271-61-9.mol

Synonyms:71271-61-9;1-(pyridin-3-yl)propan-2-amine;1-Methyl-2-pyridin-3-yl-ethylamine;1-pyridin-3-ylpropan-2-amine;(1-methyl-2-pyridin-3-ylethyl)amine;SCHEMBL290633;CHEMBL4533731;DTXSID40405712;PUEWSNLDTZQXLN-UHFFFAOYSA-N;MFCD06408744;AKOS000148740;AKOS016345675;AB23775;1-(3-PYRIDINYL)-2-PROPANAMINE;s12145;BP-11172;BS-36210;METHYL4-FORMYL-3-NITROBENZOATE97;A9345;CS-0005280;FT-0683312;EN300-659004;(1-Methyl-2-pyridin-3-ylethyl)amine, AldrichCPR

Chemical Property of 1-(Pyridin-3-yl)propan-2-amine

Chemical Property:

• Vapor Pressure: 0.0449mmHg at 25°C
• Refractive Index: 1.529
• Boiling Point: 237.4 °C at 760 mmHg
• Flash Point: 118 °C
• PSA: 38.91000
• Density: 1.001 g/cm³
• LogP: 1.67160
• XLogP3: 0.6
• Hydrogen Bond Donor Count: 1
• Hydrogen Bond Acceptor Count: 2
• Rotatable Bond Count: 2
• Exact Mass: 136.100048391
• Heavy Atom Count: 10
• Complexity: 93.3

Purity/Quality:

99% ^*data from raw suppliers

1-Methyl-2-pyridin-3-yl-ethylamine ^*data from reagent suppliers

Safty Information:

• Pictogram(s): T
• Hazard Codes: T
• Statements: 25-36
• Safety Statements: 26-45

MSDS Files:

SDS file from LookChem

Useful:

• Canonical SMILES: CC(CC1=CN=CC=C1)N

Technology Process of 1-(Pyridin-3-yl)propan-2-amine

There total 12 articles about 1-(Pyridin-3-yl)propan-2-amine 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: 94.7%

→ (+/-)-1-(3-pyridyl)propan-2-amine (71271-61-9)

Guidance literature:

With lithium aluminium tetrahydride; In tetrahydrofuran; for 0.5h; Reflux; Cooling with ice;

Reference yield: 33.0%

(E)-3-(2-nitroprop-1-en-1-yl)pyridine (106508-04-7) → (+/-)-1-(3-pyridyl)propan-2-amine (71271-61-9)

Guidance literature:

With lithium aluminium tetrahydride; In tetrahydrofuran; for 12h; Inert atmosphere; Reflux;

DOI:10.1039/c0ob00800a

Reference yield:

2-nitro-1-(3-pyridinyl)-1-propene (3156-53-4) → (+/-)-1-(3-pyridyl)propan-2-amine (71271-61-9)

Guidance literature:

Multi-step reaction with 2 steps

1: LiAlH₄; diethyl ether

2: LiAlH₄; diethyl ether

With lithium aluminium tetrahydride; diethyl ether;

DOI:10.1021/jo01353a010

upstream raw materials:

1-(pyridin-3-yl)-2-propanone

ammonium formate

[3]pyridyl-acetone oxime

2-nitro-1-(3-pyridinyl)-1-propene

Downstream raw materials:

(1R,2S,5R)-2-isopropyl-5-methyl-N-(1-(pyridin-3-yl)propan-2-yl)cyclohexanecarboxamide

Refernces

• 1、 Rodriguez-Mata, Maria,Gotor-Fernandez, Vicente,Gonzalez-Sabin, Javier,Rebolledo, Francisca,Gotor, Vicente. "Straightforward preparation of biologically active 1-aryl- and 1-heteroarylpropan-2-amines in enantioenriched form". . p. 2274 - 2278. Retrieved 2011/05/02.
• 2、 -. "PYRAZINONE THROMBIN INHIBITORS". . . Retrieved 2008/06/13.