Acetic acid, ((6-(4-chlorophenoxy)-4-pyrimidinyl)thio)-, hydrazide

Base Information

• Chemical Name: Acetic acid, ((6-(4-chlorophenoxy)-4-pyrimidinyl)thio)-, hydrazide
• CAS No.: 137927-75-4
• Molecular Formula: C12H11 Cl N4 O2 S
• Molecular Weight: 310.75934
• DSSTox Substance ID: DTXSID50160401
• Nikkaji Number: J442.248A
• Wikidata: Q83028760
• Mol file: 137927-75-4.mol

Synonyms:137927-75-4;Acetic acid, ((6-(4-chlorophenoxy)-4-pyrimidinyl)thio)-, hydrazide;BRN 5447466;2-[6-(4-chlorophenoxy)pyrimidin-4-yl]sulfanylacetohydrazide;((6-(4-Chlorophenoxy)-4-pyrimidinyl)thio)acetic acid hydrazide;C12H11ClN4O2S;DTXSID50160401;WRMHKXIWDZVDJX-UHFFFAOYSA-N;C12-H11-Cl-N4-O2-S;2-[6-(4-Chlorophenoxy)pyrimidin-4-ylthio]acetohydrazide

Chemical Property of Acetic acid, ((6-(4-chlorophenoxy)-4-pyrimidinyl)thio)-, hydrazide

Chemical Property:

• Vapor Pressure: 7.11E-12mmHg at 25°C
• Boiling Point: 543.5°C at 760 mmHg
• Flash Point: 282.5°C
• PSA: 118.92000
• Density: 1.49g/cm³
• LogP: 3.54490
• XLogP3: 2.1
• Hydrogen Bond Donor Count: 2
• Hydrogen Bond Acceptor Count: 6
• Rotatable Bond Count: 5
• Exact Mass: 310.0291245
• Heavy Atom Count: 20
• Complexity: 316

Purity/Quality:

((6-(4-CHLOROPHENOXY)-4-PYRIMIDINYL)THIO)ACETIC ACID HYDRAZIDE 95.00% ^*data from reagent suppliers

Safty Information:

• Pictogram(s):  
• Hazard Codes: 

MSDS Files:

SDS file from LookChem

Useful:

• Canonical SMILES: C1=CC(=CC=C1OC2=CC(=NC=N2)SCC(=O)NN)Cl

Technology Process of Acetic acid, ((6-(4-chlorophenoxy)-4-pyrimidinyl)thio)-, hydrazide

There total 1 articles about Acetic acid, ((6-(4-chlorophenoxy)-4-pyrimidinyl)thio)-, hydrazide 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: 96.0%

ethyl <6-(4-chlorophenoxy)-4-pyrimidinylthio>acetate (124066-44-0) → [6-(4-Chloro-phenoxy)-pyrimidin-4-ylsulfanyl]-acetic acid hydrazide (137927-75-4)

Guidance literature:

With hydrazine hydrate; In ethanol; for 0.5h; Ambient temperature;

DOI:10.1007/BF00767268

Reference yield: 90.0%

[6-(4-Chloro-phenoxy)-pyrimidin-4-ylsulfanyl]-acetic acid hydrazide (137927-75-4) + acetone (67-64-1) → [6-(4-Chloro-phenoxy)-pyrimidin-4-ylsulfanyl]-acetic acid isopropylidene-hydrazide (137927-79-8)

Guidance literature:

for 0.5h; Ambient temperature;

DOI:10.1007/BF00767268

upstream raw materials:

ethyl <6-(4-chlorophenoxy)-4-pyrimidinylthio>acetate

Downstream raw materials:

[6-(4-Chloro-phenoxy)-pyrimidin-4-ylsulfanyl]-acetic acid isopropylidene-hydrazide

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