3-(Trifluoromethyl)phenylhydrazine

Base Information

• Chemical Name: 3-(Trifluoromethyl)phenylhydrazine
• CAS No.: 368-78-5
• Molecular Formula: C7H7 F3 N2
• Molecular Weight: 176.141
• Hs Code.: 29280090
• European Community (EC) Number: 206-713-5
• NSC Number: 157345
• UNII: 4ZGA5B6Z3H
• DSSTox Substance ID: DTXSID60190274
• Nikkaji Number: J213.555H
• Wikidata: Q83062616
• Mol file: 368-78-5.mol

Synonyms:3-(Trifluoromethyl)phenylhydrazine;368-78-5;(3-(Trifluoromethyl)phenyl)hydrazine;[3-(trifluoromethyl)phenyl]hydrazine;Hydrazine, [3-(trifluoromethyl)phenyl]-;4ZGA5B6Z3H;EINECS 206-713-5;NSC-157345;Hydrazine, (3-(trifluoromethyl)phenyl)-;3-trifluoromethylphenylhydrazine;(3-(trifluoromethyl)phenyl)hydrazinehydrochloride;MFCD00025093;Enamine_001261;UNII-4ZGA5B6Z3H;SCHEMBL125625;m-trifluoromethylphenyl hydrazine;3-trifluoromethyl phenylhydrazine;3-trifluoromethyl-phenylhydrazine;C(F)(F)(F)c1cccc(NN)c1;m-Trifluoromethylphenyl-hydrazine;3-Trifluoromethylphenyl hydrazine;DTXSID60190274;(3-trifluoromethylphenyl)hydrazine;HMS1397J07;3-(trifluoromethyl) phenylhydrazine;3-(trifluoromethyl)-phenylhydrazine;3-(trifluoromethyl)phenyl hydrazine;(3-trifluoromethyl-phenyl)-hydrazine;BBL022182;NSC157345;STK501153;AKOS000312965;CS-W017416;NSC 157345;1-(3-(trifluoromethyl)phenyl)hydrazine;3-(Trifluoromethyl)phenylhydrazine, 95%;AC-29640;BP-12777;1-[3-(Trifluoromethyl)phenyl]hydrazine #;A5641;BB 0219957;FT-0613953;T2411;(alpha,alpha,alpha-trifluoro-m-tolyl)-hydrazine;[3-(trifluoromethyl)phenyl]hydrazine,hydrochloride;12D-913;A823421;(3-Trifluoromethyl-phenyl)-hydrazine;hydrochloride;1-(3-(trifluoromethyl)phenyl)hydrazine hydrochloride;n'-(3-trifluoromethyl-phenyl)-hydrazinium, chloride;W-106581;F2121-0402;3-(Trifluoromethyl)phenylhydrazine, technical grade, 90%

Chemical Property of 3-(Trifluoromethyl)phenylhydrazine

Chemical Property:

• Appearance/Colour: Colorless to light yellow liquid
• Vapor Pressure: 0.0975mmHg at 25°C
• Refractive Index: n20/D 1.504(lit.)
• Boiling Point: 204.6 °C at 760 mmHg
• PKA: 4?+-.0.10(Predicted)
• Flash Point: 107.2 °C
• PSA: 38.05000
• Density: 1.359 g/cm³
• LogP: 2.76430
• Storage Temp.: Refrigerator, under inert atmosphere
• Solubility.: Chloroform (Slightly), Methanol (Slightly)
• Water Solubility.: Not miscible or difficult to mix with water.
• XLogP3: 2.5
• Hydrogen Bond Donor Count: 2
• Hydrogen Bond Acceptor Count: 5
• Rotatable Bond Count: 1
• Exact Mass: 176.05613272
• Heavy Atom Count: 12
• Complexity: 146

Purity/Quality:

99% ^*data from raw suppliers

3-(Trifluoromethyl)phenylhydrazine ^*data from reagent suppliers

Safty Information:

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

MSDS Files:

SDS file from LookChem

Total 1 MSDS from other Authors

Useful:

• Canonical SMILES: C1=CC(=CC(=C1)NN)C(F)(F)F
• Uses: 3-(Trifluoromethyl)phenylhydrazine can be used as pesticides.

Technology Process of 3-(Trifluoromethyl)phenylhydrazine

There total 7 articles about 3-(Trifluoromethyl)phenylhydrazine 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: 69.0%

3-(trifluoromethyl)-aniline hydrochloride (2646-97-1) → 3-(trifluoromethyl)phenylhydrazine (368-78-5)

Guidance literature:

3-(trifluoromethyl)-aniline hydrochloride; With hydrogenchloride; sodium nitrite; In water; at 5 ℃; for 0.25h;

With hydrogenchloride; In water; for 0.166667h;

Reference yield:

3-trifluoromethylaniline (98-16-8) → 3-(trifluoromethyl)phenylhydrazine (368-78-5)

Guidance literature:

Multistep reaction; (i) NaNO₂, aq. HCl, (ii) SnCl₂;

DOI:10.1016/S0040-4020(01)93332-0

Reference yield:

3-chlorotrifluoromethylbenzene (98-15-7) → 3-(trifluoromethyl)phenylhydrazine (368-78-5)

Guidance literature:

With chloro[2-(dicyclohexylphosphino)-3 ,6-dimethoxy-2’,4’, 6’-triisopropyl- 1,1’-biphenyl] [2-(2-aminoethyl)phenyl]palladium(II); sodium t-butanolate; hydrazine; In tetrahydrofuran; at 20 ℃; for 0.025h; Flow reactor; Sonication; Inert atmosphere;

DOI:10.1002/anie.201208544

upstream raw materials:

3-trifluoromethylaniline

m-trifluoromethyldiazonium chloride

3-chlorotrifluoromethylbenzene

3-(trifluoromethyl)-aniline hydrochloride

Downstream raw materials:

3-Trifluoromethyl-benzoic acid N'-(3-trifluoromethyl-phenyl)-hydrazide

C₁₅H₁₄F₃N₃S

C₉H₁₀F₃N₃O

C₁₂H₁₄F₃N₃S

Refernces

• 1、 Hoda, Nasimul,Maqbool, Mudasir,Rajvansh, Roshani,Srividya, Kottapalli. "Deciphering the robustness of pyrazolo-pyridine carboxylate core structure-based compounds for inhibiting α-synuclein in transgenic C. elegans model of Synucleinopathy". . . Retrieved 2020/07/21.
• 2、 Chen, Ying-Ho,Lee, Ming,Lin, Yi-Zhen,Leow, Dasheng. "Remazol-Catalyzed Hydroperoxyarylation of Styrenes". supporting information. p. 1618 - 1621. Retrieved 2015/08/06.