Hydrazinecarbothioamide, N-ethyl-2-(phenylmethylene)-

Base Information

• Chemical Name: Hydrazinecarbothioamide, N-ethyl-2-(phenylmethylene)-
• CAS No.: 80550-04-5
• Molecular Formula: C10H13N3S
• Molecular Weight: 207.299
• DSSTox Substance ID: DTXSID90402650
• Mol file: 80550-04-5.mol

Synonyms:80550-04-5;Hydrazinecarbothioamide, N-ethyl-2-(phenylmethylene)-;DTXSID90402650

Chemical Property of Hydrazinecarbothioamide, N-ethyl-2-(phenylmethylene)-

Chemical Property:

• XLogP3: 2.6
• Hydrogen Bond Donor Count: 2
• Hydrogen Bond Acceptor Count: 2
• Rotatable Bond Count: 3
• Exact Mass: 207.08301860
• Heavy Atom Count: 14
• Complexity: 198

Purity/Quality:

85.0-99.8% ^*data from raw suppliers

Safty Information:

• Pictogram(s):  
• Hazard Codes: 

MSDS Files:

SDS file from LookChem

Useful:

• Canonical SMILES: CCNC(=S)NN=CC1=CC=CC=C1

Technology Process of Hydrazinecarbothioamide, N-ethyl-2-(phenylmethylene)-

There total 1 articles about Hydrazinecarbothioamide, N-ethyl-2-(phenylmethylene)- 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: 94.0%

N-ethylthiosemicarbazide (13431-34-0) + benzaldehyde (100-52-7) → 2-benzylidene-N-ethylhydrazinecarbothioamide (80550-04-5)

Guidance literature:

In ethanol; for 0.25h; Inert atmosphere; Reflux;

DOI:10.1002/hlca.201300077

Reference yield: 78.0%

2-benzylidene-N-ethylhydrazinecarbothioamide (80550-04-5) + palladium diacetate (3375-31-3) → C20H24N6PdS2

Guidance literature:

In ethanol; at 20 ℃; for 18h;

DOI:10.1139/cjc-2018-0108

Reference yield: 70.0%

[ruthenium(II)(η6-1-methyl-4-isopropyl-benzene)(chloride)(μ-chloride)]2 (52462-29-0) + 2-benzylidene-N-ethylhydrazinecarbothioamide (80550-04-5) + water (7732-18-5) → [(η6-p-cymene)RuII(N1,S-(C6H5CHNNHC(S)NHEt))Cl]Cl*1.25H2O

Guidance literature:

[ruthenium(II)(η⁶-1-methyl-4-isopropyl-benzene)(chloride)(μ-chloride)]₂; 2-benzylidene-N-ethylhydrazinecarbothioamide; In acetone; for 3h; Reflux;

water;

DOI:10.1039/C6DT03306G

upstream raw materials:

N-ethylthiosemicarbazide

benzaldehyde

Downstream raw materials:

2-(ethylamino)-5-phenyl-1,3,4-thiadiazole

2-benzylidenehydrazono-3-ethyl-4-methyl-2,3-dihydro-thiazole-5-carboxylic acid ethyl ester

ethyl-(3-ethyl-5-phenyl-3H-[1,3,4]thiadiazol-2-yliden)-amine