1-{2,6-Bis[(1,3-dithian-2-yl)methyl]phenyl}-1H-pyrrole

Base Information

Chemical Name:1-{2,6-Bis[(1,3-dithian-2-yl)methyl]phenyl}-1H-pyrrole
CAS No.:89208-02-6
Molecular Formula:C20H25NS4
Molecular Weight:407.689
Hs Code.:
DSSTox Substance ID:DTXSID70518824
Wikidata:Q82381651

Synonyms:89208-02-6;DTXSID70518824;1-{2,6-Bis[(1,3-dithian-2-yl)methyl]phenyl}-1H-pyrrole

Suppliers and Price of 1-{2,6-Bis[(1,3-dithian-2-yl)methyl]phenyl}-1H-pyrrole

Supply Marketing:

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

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Chemical Property of 1-{2,6-Bis[(1,3-dithian-2-yl)methyl]phenyl}-1H-pyrrole

Chemical Property:

XLogP3:6
Hydrogen Bond Donor Count:0
Hydrogen Bond Acceptor Count:4
Rotatable Bond Count:5
Exact Mass:407.08698450
Heavy Atom Count:25
Complexity:361

Purity/Quality:

Safty Information:

Pictogram(s):
Hazard Codes:

MSDS Files:

Useful:

Canonical SMILES:C1CSC(SC1)CC2=C(C(=CC=C2)CC3SCCCS3)N4C=CC=C4

Technology Process of 1-{2,6-Bis[(1,3-dithian-2-yl)methyl]phenyl}-1H-pyrrole

There total 3 articles about 1-{2,6-Bis[(1,3-dithian-2-yl)methyl]phenyl}-1H-pyrrole 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: 60.0%

: 505-23-7
1,3 dithiane

: 89208-01-5
N<2,6-Bis(brommethyl)phenyl>pyrrol

: 89208-02-6
N-<2,6-Bis<(1,3-dithian-2-yl)methyl>phenyl>pyrrol

Guidance literature:: With n-butyllithium; In tetrahydrofuran; hexane; at -40 - -20 ℃; for 10h;
DOI:10.1002/hlca.19830660724

Reference yield:

: 89208-00-4
2-(1-Pyrrolyl)benzol-1,3-dimethanol

: 89208-02-6
N-<2,6-Bis<(1,3-dithian-2-yl)methyl>phenyl>pyrrol

Guidance literature:: Multi-step reaction with 2 steps

1: 80 percent / PBr₃ / diethyl ether / 5 h / Heating

2: 60 percent / BuLi / tetrahydrofuran; hexane / 10 h / -40 - -20 °C

With n-butyllithium; phosphorus tribromide; In tetrahydrofuran; diethyl ether; hexane;
DOI:10.1002/hlca.19830660724

Reference yield:

: 89207-99-8
2-(1-Pyrrolyl)isophtalsaeure-dimethylester

: 89208-02-6
N-<2,6-Bis<(1,3-dithian-2-yl)methyl>phenyl>pyrrol

Guidance literature:: Multi-step reaction with 3 steps

1: 92 percent / LiAlH₄ / diethyl ether / 24 h / Heating

2: 80 percent / PBr₃ / diethyl ether / 5 h / Heating

3: 60 percent / BuLi / tetrahydrofuran; hexane / 10 h / -40 - -20 °C

With lithium aluminium tetrahydride; n-butyllithium; phosphorus tribromide; In tetrahydrofuran; diethyl ether; hexane;
DOI:10.1002/hlca.19830660724