2-(4-Isopropylphenoxy)acetohydrazide

Base Information

• Chemical Name: 2-(4-Isopropylphenoxy)acetohydrazide
• CAS No.: 443905-53-1
• Molecular Formula: C₁₁H₁₆N₂O₂
• Molecular Weight: 208.26
• Hs Code.: 2928000090
• DSSTox Substance ID: DTXSID50359535
• Wikidata: Q82140785
• Mol file: 443905-53-1.mol

Synonyms:2-(4-isopropylphenoxy)acetohydrazide;443905-53-1;2-(4-propan-2-ylphenoxy)acetohydrazide;2-[4-(propan-2-yl)phenoxy]acetohydrazide;Oprea1_818532;DTXSID50359535;BBL015375;MFCD00553733;STK049419;AKOS000305337;VS-04937;CS-0314775

Chemical Property of 2-(4-Isopropylphenoxy)acetohydrazide

Chemical Property:

• Vapor Pressure: 8.13E-07mmHg at 25°C
• Refractive Index: 1.533
• Boiling Point: 406.4°C at 760 mmHg
• PKA: 12.26±0.35(Predicted)
• Flash Point: 199.6°C
• PSA: 64.35000
• Density: 1.098g/cm³
• LogP: 2.26990
• XLogP3: 1.7
• Hydrogen Bond Donor Count: 2
• Hydrogen Bond Acceptor Count: 3
• Rotatable Bond Count: 4
• Exact Mass: 208.121177757
• Heavy Atom Count: 15
• Complexity: 199

Purity/Quality:

97% ^*data from raw suppliers

2-(4-isopropylphenoxy)acetohydrazide ^*data from reagent suppliers

Safty Information:

• Pictogram(s):  
• Hazard Codes: 

MSDS Files:

SDS file from LookChem

Useful:

• Canonical SMILES: CC(C)C1=CC=C(C=C1)OCC(=O)NN

Technology Process of 2-(4-Isopropylphenoxy)acetohydrazide

There total 2 articles about 2-(4-Isopropylphenoxy)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: 97.0%

methyl (4-(1-methylethyl)phenoxy)acetate (184878-97-5) → 2-(4-isopropylphenoxy)acetohydrazide (443905-53-1)

Guidance literature:

With hydrazine hydrate; In methanol; for 16h; Reflux;

DOI:10.3390/antibiotics10040438

Reference yield:

4-Isopropylphenol (99-89-8) → 2-(4-isopropylphenoxy)acetohydrazide (443905-53-1)

Guidance literature:

Multi-step reaction with 2 steps

1: potassium carbonate / N,N-dimethyl-formamide / 1.5 h / 50 °C

2: hydrazine hydrate / methanol / 16 h / Reflux

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

DOI:10.3390/antibiotics10040438

upstream raw materials:

4-Isopropylphenol

methyl (4-(1-methylethyl)phenoxy)acetate