1-Oxo-2-phenyl-1H-inden-3-yl thiocyanate

Base Information

Chemical Name:1-Oxo-2-phenyl-1H-inden-3-yl thiocyanate
CAS No.:91512-16-2
Molecular Formula:C16H9NOS
Molecular Weight:263.32
Hs Code.:
DSSTox Substance ID:DTXSID00530130
Wikidata:Q82401070

Synonyms:91512-16-2;1-Oxo-2-phenyl-1H-inden-3-yl thiocyanate;DTXSID00530130

Suppliers and Price of 1-Oxo-2-phenyl-1H-inden-3-yl thiocyanate

Supply Marketing:

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

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Chemical Property of 1-Oxo-2-phenyl-1H-inden-3-yl thiocyanate

Chemical Property:

XLogP3:3.8
Hydrogen Bond Donor Count:0
Hydrogen Bond Acceptor Count:3
Rotatable Bond Count:2
Exact Mass:263.04048508
Heavy Atom Count:19
Complexity:453

Purity/Quality:

Safty Information:

Pictogram(s):
Hazard Codes:

MSDS Files:: SDS file from LookChem

Useful:

Canonical SMILES:C1=CC=C(C=C1)C2=C(C3=CC=CC=C3C2=O)SC#N

Technology Process of 1-Oxo-2-phenyl-1H-inden-3-yl thiocyanate

There total 2 articles about 1-Oxo-2-phenyl-1H-inden-3-yl thiocyanate 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: 87.0%

: 19096-28-7
3-bromo-2-phenyl-1H-inden-1-one

: 333-20-0
potassium thioacyanate

: 91512-16-2
1-oxo-2-phenyl-3-indenyl thiocyanate

Guidance literature:: In methanol; benzene; for 1.5h;

Reference yield:

: 83-12-5
phenindione

: 91512-16-2
1-oxo-2-phenyl-3-indenyl thiocyanate

Guidance literature:: Multi-step reaction with 2 steps

1: 36 percent / P₂O₅, HBr(g) / dimethylformamide / 1 h

2: 87 percent / methanol; benzene / 1.5 h

With hydrogen bromide; phosphorus pentoxide; In methanol; N,N-dimethyl-formamide; benzene;