Thiophene, 3-[4-(methylthio)phenyl]-2-(4-nitrophenyl)-

Base Information

Chemical Name:Thiophene, 3-[4-(methylthio)phenyl]-2-(4-nitrophenyl)-
CAS No.:140423-16-1
Molecular Formula:C₁₇H₁₃NO₂S₂
Molecular Weight:327.428
Hs Code.:
DSSTox Substance ID:DTXSID10441228
Wikidata:Q82257903
Mol file:140423-16-1.mol

Synonyms:Thiophene, 3-[4-(methylthio)phenyl]-2-(4-nitrophenyl)-;140423-16-1;SCHEMBL8985476;DTXSID10441228;PVEMGWHECPBHMN-UHFFFAOYSA-N;3-[4-(methylthio)phenyl]-2-(4-nitrophenyl)thiophene

Suppliers and Price of Thiophene, 3-[4-(methylthio)phenyl]-2-(4-nitrophenyl)-

Supply Marketing:

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

Manufacturers and distributors:

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Chemicals and raw materials
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Total 0 raw suppliers

Chemical Property of Thiophene, 3-[4-(methylthio)phenyl]-2-(4-nitrophenyl)-

Chemical Property:

XLogP3:5.2
Hydrogen Bond Donor Count:0
Hydrogen Bond Acceptor Count:4
Rotatable Bond Count:3
Exact Mass:327.03877100
Heavy Atom Count:22
Complexity:371

Purity/Quality:

Safty Information:

Pictogram(s):
Hazard Codes:

MSDS Files:: SDS file from LookChem

Useful:

Canonical SMILES:CSC1=CC=C(C=C1)C2=C(SC=C2)C3=CC=C(C=C3)[N+](=O)[O-]

Technology Process of Thiophene, 3-[4-(methylthio)phenyl]-2-(4-nitrophenyl)-

There total 9 articles about Thiophene, 3-[4-(methylthio)phenyl]-2-(4-nitrophenyl)- 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:

: 104-03-0
4-nitrobenzeneacetic acid

: 140423-16-1
3-(4-Methylsulfanyl-phenyl)-2-(4-nitro-phenyl)-thiophene

Guidance literature:: Multi-step reaction with 8 steps

1: 42 percent / NaOMe, Ac₂O / 24 h / Heating

2: PCl₅ / CH₂Cl₂ / 1 h / Ambient temperature

3: NaN₃, aq. Na₂CO₃ / acetone; H₂O / 2 h / Ambient temperature

4: AcOH / H₂O / 3 h / Heating

5: 1.) POCl₃ / 1.) 1,2-dichloroethane, RT, 30 min, 2.) 1,2-dichloroethane, reflux, 10 h

6: 60 percent / Et₃N, pyridine / 1.) 70 deg C, 1 h, 2.) reflux, 3 h

7: 4N aq. NaOH / tetrahydrofuran / 1 h / Ambient temperature

8: Cu, quinoline / 5 h / Heating

With pyridine; quinoline; sodium hydroxide; sodium azide; phosphorus pentachloride; sodium methylate; acetic anhydride; copper; sodium carbonate; acetic acid; triethylamine; trichlorophosphate; In tetrahydrofuran; dichloromethane; water; acetone;
DOI:10.1248/cpb.46.279

Reference yield:

: 3446-89-7
4-(Methylthio)benzaldehyde

: 140423-16-1
3-(4-Methylsulfanyl-phenyl)-2-(4-nitro-phenyl)-thiophene

Guidance literature:: Multi-step reaction with 8 steps

1: 42 percent / NaOMe, Ac₂O / 24 h / Heating

2: PCl₅ / CH₂Cl₂ / 1 h / Ambient temperature

3: NaN₃, aq. Na₂CO₃ / acetone; H₂O / 2 h / Ambient temperature

4: AcOH / H₂O / 3 h / Heating

5: 1.) POCl₃ / 1.) 1,2-dichloroethane, RT, 30 min, 2.) 1,2-dichloroethane, reflux, 10 h

6: 60 percent / Et₃N, pyridine / 1.) 70 deg C, 1 h, 2.) reflux, 3 h

7: 4N aq. NaOH / tetrahydrofuran / 1 h / Ambient temperature

8: Cu, quinoline / 5 h / Heating

With pyridine; quinoline; sodium hydroxide; sodium azide; phosphorus pentachloride; sodium methylate; acetic anhydride; copper; sodium carbonate; acetic acid; triethylamine; trichlorophosphate; In tetrahydrofuran; dichloromethane; water; acetone;
DOI:10.1248/cpb.46.279

Reference yield:

: 140423-09-2
2-(4-Methylsulfanyl-phenyl)-1-(4-nitro-phenyl)-ethanone

: 140423-16-1
3-(4-Methylsulfanyl-phenyl)-2-(4-nitro-phenyl)-thiophene

Guidance literature:: Multi-step reaction with 4 steps

1: 1.) POCl₃ / 1.) 1,2-dichloroethane, RT, 30 min, 2.) 1,2-dichloroethane, reflux, 10 h

2: 60 percent / Et₃N, pyridine / 1.) 70 deg C, 1 h, 2.) reflux, 3 h

3: 4N aq. NaOH / tetrahydrofuran / 1 h / Ambient temperature

4: Cu, quinoline / 5 h / Heating

With pyridine; quinoline; sodium hydroxide; copper; triethylamine; trichlorophosphate; In tetrahydrofuran;
DOI:10.1248/cpb.46.279