(4-(Methylthio)phenyl)hydrazine hydrochloride

Base Information

• Chemical Name: (4-(Methylthio)phenyl)hydrazine hydrochloride
• CAS No.: 58626-97-4
• Molecular Formula: C7H10N2S.ClH
• Molecular Weight: 190.697
• European Community (EC) Number: 814-073-9,831-936-5
• DSSTox Substance ID: DTXSID50375452
• Mol file: 58626-97-4.mol

Synonyms:35588-53-5;58626-97-4;(4-methylsulfanylphenyl)hydrazine Hydrochloride;(4-(Methylthio)phenyl)hydrazine hydrochloride;4-(methylthio)phenylhydrazine hydrochloride;[4-(Methylthio)phenyl]hydrazine hydrochloride;(4-methylsulfanylphenyl)hydrazine;hydrochloride;[4-(methylsulfanyl)phenyl]hydrazine hydrochloride;[p-(methylthio)phenyl]hydrazine hydrochloride;4-(Methylsulphanyl)phenylhydrazine hydrochloride;Hydrazine, [4-(methylthio)phenyl]-, monohydrochloride;1-(4-(methylthio)phenyl)hydrazine hcl;(4-(Methylthio)phenyl)hydrazine hydrochloride(1:x);SCHEMBL3368547;DTXSID50375452;FIOHWWJATARMKM-UHFFFAOYSA-N;4-(Methylthio)phenylhydrazine HCl;MFCD04039174;AKOS015849535;AB90813;AS-41167;CS-0240207;FT-0639267;[4-(methylthio)phenyl]-hydrazine hydrochloride;EN300-226731;(4-methylsulfanyl-phenyl)-hydrazine hydrochloride;1-(4-(methylthio)phenyl)hydrazine hydrochloride;(4-(Methylthio)phenyl)hydrazinehydrochloride(1:x);4-(Methylthio)phenylhydraZine hydrochloride, 95%;A822891;A898222;[4-(Methylsulfanyl)phenyl]hydrazine--hydrogen chloride (1/1)

Chemical Property of (4-(Methylthio)phenyl)hydrazine hydrochloride

Chemical Property:

• Vapor Pressure: 0.000806mmHg at 25°C
• Melting Point: 198-199℃
• PSA: 63.35000
• LogP: 3.26940
• Hydrogen Bond Donor Count: 3
• Hydrogen Bond Acceptor Count: 3
• Rotatable Bond Count: 2
• Exact Mass: 190.0331472
• Heavy Atom Count: 11
• Complexity: 89.6

Purity/Quality:

97% ^*data from raw suppliers

1-(4-(Methylthio)phenyl)hydrazineHydrochloride ^*data from reagent suppliers

Safty Information:

• Pictogram(s):  
• Hazard Codes: 

MSDS Files:

SDS file from LookChem

Useful:

• Canonical SMILES: CSC1=CC=C(C=C1)NN.Cl

Technology Process of (4-(Methylthio)phenyl)hydrazine hydrochloride

There total 5 articles about (4-(Methylthio)phenyl)hydrazine hydrochloride 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: 87.0%

(4-bromophenyl)thioanisole (104-95-0) → [p-(methylthio)phenyl]hydrazine hydrochloride (58626-97-4,35588-53-5)

Guidance literature:

(4-bromophenyl)thioanisole; With potassium phosphate; copper(l) iodide; N,N′-bis(2,6-dimethylphenyl)oxalamide; cetyltrimethylammonim bromide; In water; at 80 ℃; for 0.25h; Schlenk technique; Inert atmosphere; Sealed tube;

With hydrazine hydrate; In water; at 80 ℃; Inert atmosphere; Schlenk technique; Sealed tube;

With hydrogenchloride; In water; pH=3 - 4; Inert atmosphere; Schlenk technique; Sealed tube;

DOI:10.1002/cjoc.201800326

Reference yield: 75.0%

4-methylsulfanylaniline (104-96-1) → [p-(methylthio)phenyl]hydrazine hydrochloride (58626-97-4,35588-53-5)

Guidance literature:

4-methylsulfanylaniline; With hydrogenchloride; at 120 ℃;

With sodium nitrite; at -5 ℃; for 0.25h;

With hydrogenchloride; tin(ll) chloride; at -20 - -5 ℃; Further stages.;

DOI:10.1021/jm0705096

Reference yield: 75.0%

N,N'-bis-(t-butoxycarbonyl)-4-(methylthio)phenylhydrazine (115171-09-0) → [p-(methylthio)phenyl]hydrazine hydrochloride (58626-97-4,35588-53-5)

Guidance literature:

With hydrogenchloride; In 1,4-dioxane; isopropyl alcohol; for 0.25h; Heating;

DOI:10.1016/S0040-4039(00)96662-0

upstream raw materials:

N,N'-bis-(t-butoxycarbonyl)-4-(methylthio)phenylhydrazine

4-methylsulfanylaniline

4-thioanisolemagnesium bromide

(4-bromophenyl)thioanisole

Downstream raw materials:

1-[4-(methylthio)phenyl]pyrazole

2,3,4,5-tetrahydro-8-methylthio-2-(phenylmethyl)-1H-pyrido[4,3-b]indole

1-(4-(methylthio)phenyl)-5-(p-tolyl)-3-(trifluoromethyl)-1H-pyrazole

2-(5-methylsulfanyl-indol-3-yl)-ethylamine; hydrochloride

Refernces

• 1、 Ahlstr?m, Marie M.,Ridderstr?m, Marianne,Zamora, Ismael,Luthman, Kristina. "CYP2C9 structure-metabolism relationships: Optimizing the metabolic stability of COX-2 inhibitors". . p. 4444 - 4452. Retrieved 2008/02/13.
• 2、 -. "3-hetero-substituted-N-benzyl-indoles". . . Retrieved 2008/06/13.