2-[(7-Chloroquinolin-4-yl)thio]acetohydrazide

Base Information

• Chemical Name: 2-[(7-Chloroquinolin-4-yl)thio]acetohydrazide
• CAS No.: 306935-50-2
• Molecular Formula: C₁₁H₁₀ClN₃OS
• Molecular Weight: 267.739
• Hs Code.: 2933499090
• DSSTox Substance ID: DTXSID30370965
• Wikidata: Q82158161
• Mol file: 306935-50-2.mol

Synonyms:2-[(7-Chloroquinolin-4-yl)thio]acetohydrazide;306935-50-2;2-((7-Chloroquinolin-4-yl)thio)acetohydrazide;2-(7-chloroquinolin-4-yl)sulfanylacetohydrazide;Maybridge1_005302;Oprea1_272471;2-[(7-chloroquinolin-4-yl)sulfanyl]acetohydrazide;HMS556I22;DTXSID30370965;MFCD02180374;AKOS015897067;CCG-248397;PS-6024;SB86038;2-(7-chloroquinolin-4-ylthio)acetohydrazide;CS-0318147;FT-0610831;A820520;J-507607

Chemical Property of 2-[(7-Chloroquinolin-4-yl)thio]acetohydrazide

Chemical Property:

• Vapor Pressure: 2.66E-11mmHg at 25°C
• Melting Point: 213 °C
• Refractive Index: 1.708
• Boiling Point: 529.6 °C at 760 mmHg
• Flash Point: 274.1 °C
• PSA: 93.31000
• Density: 1.45 g/cm³
• LogP: 3.06140
• XLogP3: 2.1
• Hydrogen Bond Donor Count: 2
• Hydrogen Bond Acceptor Count: 4
• Rotatable Bond Count: 3
• Exact Mass: 267.0233108
• Heavy Atom Count: 17
• Complexity: 279

Purity/Quality:

99%, ^*data from raw suppliers

2-[(7-Chloroquinolin-4-yl)thio]acetohydrazide 97.0% ^*data from reagent suppliers

Safty Information:

• Pictogram(s): Xi,Xn
• Hazard Codes: Xi,Xn
• Statements: 20/21/22-36/37/38
• Safety Statements: 36/37/39 -22-26

MSDS Files:

SDS file from LookChem

Useful:

• Canonical SMILES: C1=CC2=C(C=CN=C2C=C1Cl)SCC(=O)NN

Technology Process of 2-[(7-Chloroquinolin-4-yl)thio]acetohydrazide

There total 3 articles about 2-[(7-Chloroquinolin-4-yl)thio]acetohydrazide 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:

7-chloro-4-hydroxylquinoline (86-99-7) → C11H10ClN3OS (306935-50-2)

Guidance literature:

Multi-step reaction with 3 steps

1: Lawessons reagent / tetrahydrofuran / 80 °C

2: potassium carbonate / N,N-dimethyl-formamide

3: hydrazine hydrate / ethanol / Reflux

With Lawessons reagent; potassium carbonate; hydrazine hydrate; In tetrahydrofuran; ethanol; N,N-dimethyl-formamide;

DOI:10.1016/j.bmcl.2011.05.100

Reference yield:

7-chloroquinolyl-4-thiol (90225-19-7) → C11H10ClN3OS (306935-50-2)

Guidance literature:

Multi-step reaction with 2 steps

1: potassium carbonate / N,N-dimethyl-formamide

2: hydrazine hydrate / ethanol / Reflux

With potassium carbonate; hydrazine hydrate; In ethanol; N,N-dimethyl-formamide;

DOI:10.1016/j.bmcl.2011.05.100

Reference yield:

methyl 2-(7-chloroquinolin-4-ylthio)acetate (874766-64-0) → C11H10ClN3OS (306935-50-2)

Guidance literature:

With hydrazine hydrate; In ethanol; Reflux;

DOI:10.1016/j.bmcl.2011.05.100

upstream raw materials:

7-chloro-4-hydroxylquinoline

7-chloroquinolyl-4-thiol

methyl 2-(7-chloroquinolin-4-ylthio)acetate

Downstream raw materials:

C₂₁H₂₀ClN₃O₄S

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