1,2,3,4-Tetrahydro-4-(4-bromophenyl)-6-phenyl-2-thioxo-3-pyridinecarbonitrile

Base Information

Chemical Name:1,2,3,4-Tetrahydro-4-(4-bromophenyl)-6-phenyl-2-thioxo-3-pyridinecarbonitrile
CAS No.:89451-39-8
Molecular Formula:C₁₈H₁₃BrN₂S
Molecular Weight:369.285
Hs Code.:
DSSTox Substance ID:DTXSID401008827

Synonyms:BRN 4704345;1,2,3,4-Tetrahydro-4-(4-bromophenyl)-6-phenyl-2-thioxo-3-pyridinecarbonitrile;3-Pyridinecarbonitrile, 1,2,3,4-tetrahydro-4-(4-bromophenyl)-6-phenyl-2-thioxo-;89451-39-8;C18H13BrN2S;C18-H13-Br-N2-S;DTXSID401008827;LS-130396;4-(4-Bromophenyl)-6-phenyl-2-sulfanyl-3,4-dihydropyridine-3-carbonitrile

Suppliers and Price of 1,2,3,4-Tetrahydro-4-(4-bromophenyl)-6-phenyl-2-thioxo-3-pyridinecarbonitrile

Supply Marketing:

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

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Chemical Property of 1,2,3,4-Tetrahydro-4-(4-bromophenyl)-6-phenyl-2-thioxo-3-pyridinecarbonitrile

Chemical Property:

Vapor Pressure:1.1E-11mmHg at 25°C
Boiling Point:538.9°Cat760mmHg
Flash Point:279.7°C
Density:1.51g/cm³
XLogP3:4.3
Hydrogen Bond Donor Count:1
Hydrogen Bond Acceptor Count:2
Rotatable Bond Count:2
Exact Mass:367.99828
Heavy Atom Count:22
Complexity:493

Purity/Quality:

Safty Information:

Pictogram(s):
Hazard Codes:

MSDS Files:: SDS file from LookChem

Useful:

Canonical SMILES:C1=CC=C(C=C1)C2=CC(C(C(=S)N2)C#N)C3=CC=C(C=C3)Br

Technology Process of 1,2,3,4-Tetrahydro-4-(4-bromophenyl)-6-phenyl-2-thioxo-3-pyridinecarbonitrile

There total 4 articles about 1,2,3,4-Tetrahydro-4-(4-bromophenyl)-6-phenyl-2-thioxo-3-pyridinecarbonitrile 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:

: 22966-09-2
(2E)-3-(4-bromophenyl)-1-phenylprop-2-en-1-one

: 89451-39-8
(3R,4S)-4-(4-Bromo-phenyl)-6-phenyl-2-thioxo-1,2,3,4-tetrahydro-pyridine-3-carbonitrile

Guidance literature:: Multi-step reaction with 2 steps

1: ethanol

2: 0.5 N HCl / ethanol / Ambient temperature

With hydrogenchloride; In ethanol;
DOI:10.1007/BF00515357

Reference yield:

: 22966-09-2
(2E)-3-(4-bromophenyl)-1-phenylprop-2-en-1-one

: 89451-39-8
(3S,4S)-4-(4-Bromo-phenyl)-6-phenyl-2-thioxo-1,2,3,4-tetrahydro-pyridine-3-carbonitrile

Guidance literature:: Multi-step reaction with 2 steps

1: ethanol

2: 0.5 N HCl / ethanol / Ambient temperature

With hydrogenchloride; In ethanol;
DOI:10.1007/BF00515357

Reference yield:

: 89451-26-3
4-(4-Bromo-phenyl)-6-hydroxy-6-phenyl-2-thioxo-piperidine-3-carbonitrile; compound with piperidine

: 89451-39-8
(3R,4S)-4-(4-Bromo-phenyl)-6-phenyl-2-thioxo-1,2,3,4-tetrahydro-pyridine-3-carbonitrile

: 89451-39-8
(3S,4S)-4-(4-Bromo-phenyl)-6-phenyl-2-thioxo-1,2,3,4-tetrahydro-pyridine-3-carbonitrile

Guidance literature:: With hydrogenchloride; In ethanol; Yield given. Yields of byproduct given. Title compound not separated from byproducts; Ambient temperature;
DOI:10.1007/BF00515357