(1E)-phenylethanal thiosemicarbazone

Base Information Edit

Chemical Name:(1E)-phenylethanal thiosemicarbazone
CAS No.:7420-49-7
Molecular Formula:C9H11 N3 S
Molecular Weight:193.272
Hs Code.:
NSC Number:76426
DSSTox Substance ID:DTXSID80424285
ChEMBL ID:CHEMBL1818886
Mol file:7420-49-7.mol

Synonyms:CHEMBL1818886;7420-49-7;NSC76426;SCHEMBL17666941;DTXSID80424285;BDBM152765;(1E)-phenylethanal thiosemicarbazone;BDBM50351005;NSC-76426;[(E)-2-phenylethylideneamino]thiourea;AKOS003452150;[(E)-(2-phenylethylidene)amino]thiourea (3j)

Suppliers and Price of (1E)-phenylethanal thiosemicarbazone

Supply Marketing:Edit

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

Total 3 raw suppliers

Chemical Property of (1E)-phenylethanal thiosemicarbazone Edit

Chemical Property:

Vapor Pressure:6.41E-05mmHg at 25°C
Boiling Point:344.8°Cat760mmHg
Flash Point:162.4°C
Density:1.17g/cm³
XLogP3:1.1
Hydrogen Bond Donor Count:2
Hydrogen Bond Acceptor Count:2
Rotatable Bond Count:3
Exact Mass:193.06736854
Heavy Atom Count:13
Complexity:185

Purity/Quality:: 99% ^*data from raw suppliers

Safty Information:

Pictogram(s):
Hazard Codes:

MSDS Files:: SDS file from LookChem

Useful:

Canonical SMILES:C1=CC=C(C=C1)CC=NNC(=S)N
Isomeric SMILES:C1=CC=C(C=C1)C/C=N/NC(=S)N

Technology Process of (1E)-phenylethanal thiosemicarbazone

There total 5 articles about (1E)-phenylethanal thiosemicarbazone 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: 81.0%

: 122-78-1
phenylacetaldehyde

: 79-19-6
thiosemicarbazide

: 7420-49-7
1-(2-phenylethylidene)thiosemicarbazide

Guidance literature:: With acetic acid; In ethanol; for 10h; Reflux;
DOI:10.1016/j.ejmech.2011.07.003

Reference yield:

: 857812-91-0
3-phenyl-2-thiosemicarbazido-propionic acid

: 7420-49-7
1-(2-phenylethylidene)thiosemicarbazide

Guidance literature:: With iodine; sodium carbonate; potassium iodide;

Reference yield:

: 156-06-9
2-oxo-3-(phenyl)propionic acid

: 7420-49-7
1-(2-phenylethylidene)thiosemicarbazide

Guidance literature:: Multi-step reaction with 3 steps

2: sodium-amalgam; water

3: aqueous Na₂CO₃-solution; aqueous solution of iodine; KI

With sodium amalgam; water; iodine; sodium carbonate; potassium iodide;