Cyclohexanone p-Toluenesulfonylhydrazone

Base Information

• Chemical Name: Cyclohexanone p-Toluenesulfonylhydrazone
• CAS No.: 4545-18-0
• Molecular Formula: C13H18N2O2S
• Molecular Weight: 266.364
• Hs Code.: 2935009090
• European Community (EC) Number: 678-364-0
• NSC Number: 132029,132020,55901
• DSSTox Substance ID: DTXSID10288458
• Nikkaji Number: J282.617H
• Mol file: 4545-18-0.mol

Synonyms:4545-18-0;Cyclohexanone Tosylhydrazone;Cyclohexanone p-Toluenesulfonylhydrazone;n'-cyclohexylidene-4-methylbenzenesulfonohydrazide;N-(cyclohexylideneamino)-4-methylbenzenesulfonamide;NSC55901;NCIOpen2_001944;AMY981;SCHEMBL16866377;DTXSID10288458;WMCVYCATQIGYIO-UHFFFAOYSA-N;MFCD00161064;NSC-55901;NSC132020;NSC132029;AKOS000979926;NSC-132020;NSC-132029;CYCLOHEXANONE (P-TOSYL)HYDRAZONE;AS-68413;C2295;CS-0204875;F53514;A872380;N'-cyclohexylidene-4-methylbenzene-1-sulfonohydrazide

Chemical Property of Cyclohexanone p-Toluenesulfonylhydrazone

Chemical Property:

• Melting Point: 161-162℃
• Boiling Point: 415.4°Cat760mmHg
• PKA: 10.48±0.20(Predicted)
• Flash Point: 205°C
• PSA: 66.91000
• Density: 1.24g/cm³
• LogP: 4.06510
• Storage Temp.: Keep in dark place,Inert atmosphere,Room temperature
• XLogP3: 2.4
• Hydrogen Bond Donor Count: 1
• Hydrogen Bond Acceptor Count: 4
• Rotatable Bond Count: 3
• Exact Mass: 266.10889899
• Heavy Atom Count: 18
• Complexity: 382

Purity/Quality:

97% ^*data from raw suppliers

Cyclohexanone p-Toluenesulfonylhydrazone ^*data from reagent suppliers

Safty Information:

• Statements: 36/37/38
• Safety Statements: 26-37-60

MSDS Files:

SDS file from LookChem

Useful:

• Canonical SMILES: CC1=CC=C(C=C1)S(=O)(=O)NN=C2CCCCC2

Technology Process of Cyclohexanone p-Toluenesulfonylhydrazone

There total 8 articles about Cyclohexanone p-Toluenesulfonylhydrazone 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: 100.0%

cyclohexanone (108-94-1,11119-77-0,9003-41-2,9075-99-4) + toluene-4-sulfonic acid hydrazide (1576-35-8) → N'-cyclohexylidene-4-methylbenzene-1-sulfonohydrazide (4545-18-0)

Guidance literature:

In methanol; at 20 ℃; for 3h;

DOI:10.1055/s-0034-1379616

Reference yield: 93.0%

1,2,4-Trioxaspiro<4.5>decan (177-12-8) + toluene-4-sulfonic acid hydrazide (1576-35-8) → N'-cyclohexylidene-4-methylbenzene-1-sulfonohydrazide (4545-18-0)

Guidance literature:

With triethylamine; In dichloromethane; for 0.2h;

DOI:10.1016/0040-4020(95)00431-7

Reference yield: 88.0%

C13H17N3O4S (85814-68-2) → N'-cyclohexylidene-4-methylbenzene-1-sulfonohydrazide (4545-18-0)

Guidance literature:

With lithium aluminium tetrahydride; In tetrahydrofuran; at 0 ℃; for 2h;

DOI:10.1055/s-1983-30254

upstream raw materials:

cyclohexanone

toluene-4-sulfonic acid hydrazide

C₁₃H₁₇N₃O₄S

1,2,4-Trioxaspiro<4.5>decan

Downstream raw materials:

cyclohex-1-enyl-trimethyl-silane

(1R*,1'RS*)-1-cyclohex-2-enyl-propan-1-ol

C₁₅H₂₅N₂O₅PS

1-cyclohexene-1-methanol