3-Chloromethyl-1-methylpiperidine hydrochloride

Base Information

• Chemical Name: 3-Chloromethyl-1-methylpiperidine hydrochloride
• CAS No.: 66496-82-0
• Molecular Formula: C7H15Cl2N
• Molecular Weight: 184.109
• Hs Code.: 2933399090
• European Community (EC) Number: 266-381-2
• DSSTox Substance ID: DTXSID80985124
• Mol file: 66496-82-0.mol

Synonyms:66496-82-0;3-Chloromethyl-1-methylpiperidine hydrochloride;3-(chloromethyl)-1-methylpiperidine hydrochloride;3-(chloromethyl)-1-methylpiperidine;hydrochloride;3-Chloromethyl-1-methylpiperidinium chloride;EINECS 266-381-2;SCHEMBL1896733;DTXSID80985124;MFCD00012833;3-chloromethyl-1-methylpiperidine HCl;AKOS015916633;SB41145;BP-10121;CS-0204616;FT-0641071;EN300-69509;3-chloromethyl-l-methylpiperidine hydrochloride;3-(chloromethyl)-1-methylpiperidinehydrochloride;3-chloromethyl-1-methyl-piperidine hydrochloride;3-Chloromethyl-1-methylpiperidine hydrochloride, 98%;Z1449592184;3-(Chloromethyl)-1-methylpiperidine--hydrogen chloride (1/1)

Chemical Property of 3-Chloromethyl-1-methylpiperidine hydrochloride

Chemical Property:

• Vapor Pressure: 0.757mmHg at 25°C
• Melting Point: 170-172oC(lit.)
• Boiling Point: 183.8°C at 760 mmHg
• Flash Point: 65°C
• PSA: 3.24000
• LogP: 2.30690
• Storage Temp.: Hygroscopic, -20°C Freezer, Under inert atmosphere
• Solubility.: Chloroform (Slightly), Methanol (Slightly), Water (Slightly)
• Hydrogen Bond Donor Count: 1
• Hydrogen Bond Acceptor Count: 1
• Rotatable Bond Count: 1
• Exact Mass: 183.0581549
• Heavy Atom Count: 10
• Complexity: 85

Purity/Quality:

98%,99%, ^*data from raw suppliers

3-Chloromethyl-1-methylpiperidine hydrochloride ^*data from reagent suppliers

Safty Information:

• Pictogram(s): Xi
• Hazard Codes: Xi
• Statements: 36/37/38
• Safety Statements: 26-37/39

MSDS Files:

SDS file from LookChem

Useful:

• Canonical SMILES: CN1CCCC(C1)CCl.Cl

Technology Process of 3-Chloromethyl-1-methylpiperidine hydrochloride

There total 1 articles about 3-Chloromethyl-1-methylpiperidine 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: 81.0%

1-methyl-3-hydroxymethylpiperidine (7583-53-1,230294-57-2) → 3-chloromethyl-1-methylpiperidine hydrochloride (66496-82-0)

Guidance literature:

With hydrogenchloride; thionyl chloride; In chloroform; for 1.5h; Heating;

DOI:10.1016/0223-5234(94)90197-X

Reference yield: 63.0%

2-[6-hydroxy-2-(3-methoxyphenyl)-4-oxo-4H-quinazolin-3-yl]-N-isopropylacetamide (909392-35-4) + 3-chloromethyl-1-methylpiperidine hydrochloride (66496-82-0) → N-isopropyl-2-[2-(3-methoxyphenyl)-6-(1-methylpiperidin-3-ylmethoxy)-4-oxo-4H-quinazolin-3-yl]acetamide

Guidance literature:

With caesium carbonate; sodium iodide; In dimethyl sulfoxide; at 85 ℃; for 16h;

Reference yield: 53.0%

1-(2,4-dihydroxy-3-methylphenyl)ethanone (10139-84-1) + 3-chloromethyl-1-methylpiperidine hydrochloride (66496-82-0) → 1-[2-hydroxy-3-methyl-4-[(1-methyl-3-piperidinyl)methoxy]phenyl]ethanone (942133-90-6)

Guidance literature:

With potassium carbonate; In various solvent(s); at 160 ℃; for 16h;

DOI:10.1021/jm0611511

upstream raw materials:

1-methyl-3-hydroxymethylpiperidine

Refernces