3-(3,4-dihydro-2H-pyrrol-2-yl)pyridine

Base Information

Chemical Name:3-(3,4-dihydro-2H-pyrrol-2-yl)pyridine
CAS No.:53844-46-5
Molecular Formula:C9H10N2
Molecular Weight:146.192
Hs Code.:
UNII:3A50Y1J4LP
DSSTox Substance ID:DTXSID80461155
Nikkaji Number:J1.826.066B
Mol file:53844-46-5.mol

Synonyms:3-(3,4-Dihydro-2H-pyrrol-2-yl)pyridine;isomyosmine;MYMD-1

Suppliers and Price of 3-(3,4-dihydro-2H-pyrrol-2-yl)pyridine

Supply Marketing:

Business phase:: The product has achieved commercial mass production^*data from LookChem market partment

Manufacturers and distributors:

Manufacture/Brand
Chemicals and raw materials
Packaging
price

American Custom Chemicals Corporation
(+/-)-ISO MYOSMINE 95.00%
5MG
$ 503.43

Medical Isotopes, Inc.
(+/-)-IsoMyosmine,TechnicalGrade
50 mg
$ 2400.00

TRC
(+/-)-IsoMyosmine,TechnicalGrade
50mg
$ 1390.00

Total 2 raw suppliers

Chemical Property of 3-(3,4-dihydro-2H-pyrrol-2-yl)pyridine

Chemical Property:

Vapor Pressure:0.00268mmHg at 25°C
Boiling Point:295.5oC at 760 mmHg
Flash Point:132.5oC
PSA：25.25000
Density:1.12g/cm3
LogP:1.42290
Storage Temp.:Amber Vial, -86°C Freezer, Under inert atmosphere
Solubility.:DMSO (Slightly), Methanol (Slightly)
XLogP3:0.3
Hydrogen Bond Donor Count:0
Hydrogen Bond Acceptor Count:2
Rotatable Bond Count:1
Exact Mass:146.084398327
Heavy Atom Count:11
Complexity:154

Purity/Quality:

90% ^*data from raw suppliers

(+/-)-ISO MYOSMINE 95.00% ^*data from reagent suppliers

Safty Information:

Pictogram(s):
Hazard Codes:

MSDS Files:: SDS file from LookChem

Useful:

Canonical SMILES:C1CC(N=C1)C2=CN=CC=C2
Uses Used in the synthesis of (+/-)-N''-Nitrosonornicotine 5''-Acetate (NNN-5’-OAc), a stable precursor of the active metabolite 5''-hydroxy(+/-)-N''-nitrosonornicotine (NNN-5''-OH). (+/-)-Isomyosmine can be used in the synthesis of (+/-)-N'-Nitrosonornicotine 5'-Acetate (NNN-5’-OAc), a stable precursor of the active metabolite 5'-hydroxy(+/-)-N'-nitrosonornicotine (NNN-5'-OH).

Technology Process of 3-(3,4-dihydro-2H-pyrrol-2-yl)pyridine

There total 7 articles about 3-(3,4-dihydro-2H-pyrrol-2-yl)pyridine 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: 100.0%

: (+/-)-N-(3-[1,3]dioxan-2-yl-1-pyridin-3-yl-propyl)-2-methyl-propanesulfinamide

: 53844-46-5
3-(3,4-dihydro-2H-pyrrol-2-yl)-pyridine

Guidance literature:: (+/-)-N-(3-[1,3]dioxan-2-yl-1-pyridin-3-yl-propyl)-2-methyl-propanesulfinamide; With water; trifluoroacetic acid; at 20 ℃; for 1h; Inert atmosphere;

With water; sodium hydrogencarbonate;
DOI:10.1021/jo9000417

Reference yield: 26.0%

: 502546-16-9
E-cyclopropyl-(3-pyridinyl)methyleneamine

: 53844-46-5
3-(3,4-dihydro-2H-pyrrol-2-yl)-pyridine

Guidance literature:: at 350 ℃; under 20 Torr;
DOI:10.1016/S0040-4039(02)02238-4

Reference yield:

: 500-22-1
3-pyridinecarboxaldehyde

: 53844-46-5
3-(3,4-dihydro-2H-pyrrol-2-yl)-pyridine

Guidance literature:: Multi-step reaction with 4 steps

1.1: tetraethoxy orthosilicate / 18 h / 160 °C

2.1: magnesium; iodine / tetrahydrofuran / 1.25 h / Reflux

2.2: -78 - 20 °C

3.1: iodine; benzol / dichloromethane / 20 °C

4.1: sulfuric acid / 4 h / Heating

With tetraethoxy orthosilicate; benzol; sulfuric acid; iodine; magnesium; In tetrahydrofuran; dichloromethane; 3.1: |Hofmann-Loeffler-Freytag Synthesis;
DOI:10.1021/acs.orglett.8b03909