4-Methyl-1-piperazinecarbonyl chloride hydrochloride

Base Information

• Chemical Name: 4-Methyl-1-piperazinecarbonyl chloride hydrochloride
• CAS No.: 55112-42-0
• Molecular Formula: C6H12Cl2N2O
• Molecular Weight: 199.08
• Hs Code.: 2933599090
• European Community (EC) Number: 259-482-8
• UNII: 7T2R5ALS8T
• DSSTox Substance ID: DTXSID80203633
• Mol file: 55112-42-0.mol

Synonyms:55112-42-0;4-Methyl-1-piperazinecarbonyl chloride hydrochloride;4-methylpiperazine-1-carbonyl chloride hydrochloride;4-Methyl-1-piperazinecarbonyl chloride HCl;4-Methylpiperazine-1-carbonyl chloride monohydrochloride;4-Methyl-1-piperazinecarbonyl chloride, HCl;1-Piperazinecarbonyl chloride, 4-methyl-, monohydrochloride;4-methylpiperazine-1-carbonyl chloride;hydrochloride;EINECS 259-482-8;N-Methylpiperazin-4-carbamoyl chloride hydrochloride;1-chlorocarbonyl-4-methylpiperazine hydrochloride;C6H11ClN2O.ClH;7T2R5ALS8T;4-Methyl-1-piperazinecarbonylChlorideHydrochloride;SCHEMBL321914;DTXSID80203633;C6-H11-Cl-N2-O.Cl-H;WICNYNXYKZNNSN-UHFFFAOYSA-N;BCP16973;GEO-01914;MFCD01074875;AKOS015897706;AC-24406;PS-10936;FT-0640293;FT-0658732;F16753;4-methylpiperazine carbonylchloride hydrochloride;EN300-1265364;1-chlorocarbonyl-4-methyl piperazine hydrochloride;1-chlorocarbonyl-4-methyl-piperazine hydrochloride;4-chlorocarbonyl-1-methyl-piperazine hydrochloride;A830496;N-Chlorocarbonyl-N'-methylpiperazine hydrochloride;4-methyl-l-piperazinecarbonyl chloride hydrochloride;W-200427;4-methyl-1-piperazine carbonyl chloride hydrochloride;4-methyl-l-piperazine carbonyl chloride hYdrochloride;4-methyl-piperazine-1-carbonyl chloride hydrochloride;4-methylpiperazin-1-ylcarbonyl chloride hydrochloride;F0001-1447;N-METHYLPIPERAZIN-4-CARBAMOYLCHLORIDEHYDROCHLORIDE;1-Piperazinecarbonyl chloride, 4-methyl-, hydrochloride (1:1)

Chemical Property of 4-Methyl-1-piperazinecarbonyl chloride hydrochloride

Chemical Property:

• Melting Point: 225-228 °C(lit.)
• Boiling Point: 247.5 °C at 760 mmHg
• Flash Point: 103.5 °C
• PSA: 23.55000
• LogP: 1.27040
• Storage Temp.: under inert gas (nitrogen or Argon) at 2-8°C
• Sensitive.: Moisture Sensitive
• Hydrogen Bond Donor Count: 1
• Hydrogen Bond Acceptor Count: 2
• Rotatable Bond Count: 0
• Exact Mass: 198.0326684
• Heavy Atom Count: 11
• Complexity: 132

Purity/Quality:

99% ^*data from raw suppliers

4-Methyl-1-piperazinecarbonyl chloride hydrochloride ^*data from reagent suppliers

Safty Information:

• Pictogram(s): C,Xi
• Hazard Codes: C,Xi
• Statements: 34
• Safety Statements: 26-27-36/37/39-45

MSDS Files:

SDS file from LookChem

Total 1 MSDS from other Authors

Useful:

• Canonical SMILES: CN1CCN(CC1)C(=O)Cl.Cl
• Uses: 4-Methyl-1-piperazinecarbonyl chloride hydrochloride may be used in the synthesis of tert-butyl 2-(N-ethyl-4-methylpiperzaine-1-carboxamido)ethylcarbamate and 4b,8,8-trimethyl-9,10-dioxo-4b,5,6,7,8,8a,9,10-octahydrophenanthren-2-yl 4-methyl-piperazine-1-carboxylate.

Technology Process of 4-Methyl-1-piperazinecarbonyl chloride hydrochloride

There total 2 articles about 4-Methyl-1-piperazinecarbonyl chloride 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: 100.0%

1-methyl-piperazine (109-01-3) + bis(trichloromethyl) carbonate (32315-10-9) → 4-methylpiperazine-1-carbonyl chloride monohydrochloride (55112-42-0)

Guidance literature:

In acetonitrile; at 20 ℃; Cooling with ice; Inert atmosphere;

Reference yield: 75.75%

1-methyl-piperazine (109-01-3) + phosgene (75-44-5) → 4-methylpiperazine-1-carbonyl chloride monohydrochloride (55112-42-0)

Guidance literature:

In chloroform; 1. 2 h, ice bath, 2. r.t., 2 h;

Reference yield: 100.0%

tert-butyl 5-(2-(3-aminophenyl)quinazolin-4-ylamino)-1H-indazole-1-carboxylate (911417-28-2) + 4-methylpiperazine-1-carbonyl chloride monohydrochloride (55112-42-0) → tert-butyl 5-(2-(3-(1-methylpiperazine-4-carboxamido)phenyl)quinazolin-4-ylamino)-1H-indazole-1-carboxylate (911417-54-4)

Guidance literature:

With triethylamine; dmap; In dichloromethane; at 20 ℃; for 18h;

upstream raw materials:

1-methyl-piperazine

phosgene

bis(trichloromethyl) carbonate

Downstream raw materials:

1-methyl-4-(aziridin-1-yl)carbonylpiperazine

1-methyl-4-(4-phenylpiperidin-1-yl)carbonylpiperazine

1-methyl-4-(4-hydroxy-4-phenylpiperidin-1-yl)carbonylpiperazine

7-chloro-4-<α-amino>-4-hydroxy-m-toluidino>quinoline