N-(Pyridin-3-yl)hydrazinecarbothioamide

Base Information

• Chemical Name: N-(Pyridin-3-yl)hydrazinecarbothioamide
• CAS No.: 34955-25-4
• Molecular Formula: C₆H₈N₄S
• Molecular Weight: 168.222
• Hs Code.: 2933399990
• DSSTox Substance ID: DTXSID50368389
• Nikkaji Number: J889.528G
• Mol file: 34955-25-4.mol

Synonyms:N-(Pyridin-3-yl)hydrazinecarbothioamide;34955-25-4;1-amino-3-pyridin-3-ylthiourea;3-amino-1-(pyridin-3-yl)thiourea;4-(Pyridin-3-yl)-thiosemicarbazide;N-pyridin-3-ylhydrazinecarbothioamide;4-(3-pyridyl)thiosemicarbazide;SCHEMBL23220314;1-(3-Pyridyl)-3-aminothiourea;DTXSID50368389;IZZXENNHSGUQCV-UHFFFAOYSA-N;4-[3-Pyridyl]-3-thiosemicarbazide;MFCD03869992;AKOS000116705;N-(3-Pyridinyl)hydrazinecarbothioamide #;CS-0219363;EN300-03817;4-(pyridine-3-yl)thiosemicarbazide, AldrichCPR;A911893;Z56887664

Chemical Property of N-(Pyridin-3-yl)hydrazinecarbothioamide

Chemical Property:

• Vapor Pressure: 0.000376mmHg at 25°C
• Melting Point: 177-178 ºC
• Refractive Index: 1.742
• Boiling Point: 317.8 °C at 760 mmHg
• Flash Point: 146 °C
• PSA: 95.06000
• Density: 1.406 g/cm³
• LogP: 1.40590
• Storage Temp.: 2-8°C
• XLogP3: 0.1
• Hydrogen Bond Donor Count: 3
• Hydrogen Bond Acceptor Count: 3
• Rotatable Bond Count: 1
• Exact Mass: 168.04696745
• Heavy Atom Count: 11
• Complexity: 139

Purity/Quality:

99% ^*data from raw suppliers

3-Amino-1-(pyridin-3-yl)thiourea ^*data from reagent suppliers

Safty Information:

• Pictogram(s): Xn
• Hazard Codes: Xn
• Statements: 22

MSDS Files:

SDS file from LookChem

Useful:

• Canonical SMILES: C1=CC(=CN=C1)NC(=S)NN

Technology Process of N-(Pyridin-3-yl)hydrazinecarbothioamide

There total 3 articles about N-(Pyridin-3-yl)hydrazinecarbothioamide 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:

pyridin-3-yl isothiocyanate (17452-27-6) → N-(pridin-3-yl)hydrazine carbothioamide (34955-25-4)

Guidance literature:

pyridin-3-yl isothiocyanate; With t-butoxycarbonylhydrazine;

With hydrogenchloride; In water;

DOI:10.1021/jm2006047

Reference yield:

C11H16N4O2S (1318765-48-8) → N-(pridin-3-yl)hydrazine carbothioamide (34955-25-4)

Guidance literature:

With hydrogenchloride; In water;

DOI:10.1021/jm2006047

Reference yield:

→ N-(pridin-3-yl)hydrazine carbothioamide (34955-25-4)

Guidance literature:

/BRN= 109640/, H2N-NH2;

DOI:10.1021/jm00193a020

upstream raw materials:

pyridin-3-yl isothiocyanate

C₁₁H₁₆N₄O₂S

Downstream raw materials:

5-amino-3-(methylsulfanyl)-1H-pyrazole-4-carbonitrile

Refernces

• 1、 Ribeiro, Amélia Galdino,Almeida, Sinara M?nica Vitalino de,de Oliveira, Jamerson Ferreira,Souza, Tulio Ricardo Couto de Lima,Santos, Keriolaine Lima dos,Albuquerque, Amanda Pinheiro de Barros,Nogueira, Mariane Cajuba de Britto Lira,Carvalho Junior, Luiz Bezerra de,Moura, Ricardo Olímpio de,da Silva, Aline Caroline,Pereira, Valéria Rêgo Alves,Castro, Maria Carolina Accioly Brelaz de,Lima, Maria do Carmo Alves de. "Novel 4-quinoline-thiosemicarbazone derivatives: Synthesis, antiproliferative activity, in vitro and in silico biomacromolecule interaction studies and topoisomerase inhibition". . . Retrieved 2019/08/20.
• 2、 Hall, Matthew D.,Brimacombe, Kyle R.,Varonka, Matthew S.,Pluchino, Kristen M.,Monda, Julie K.,Li, Jiayang,Walsh, Martin J.,Boxer, Matthew B.,Warren, Timothy H.,Fales, Henry M.,Gottesman, Michael M.. "Synthesis and structure-activity evaluation of isatin-β- thiosemicarbazones with improved selective activity toward multidrug-resistant cells expressing P-glycoprotein". experimental part. p. 5878 - 5889. Retrieved 2011/10/08.