Dimethyl 1-(chloromethyl)cyclohexane-1,2-dicarboxylate

Base Information

Chemical Name:Dimethyl 1-(chloromethyl)cyclohexane-1,2-dicarboxylate
CAS No.:85750-78-3
Molecular Formula:C11H17ClO4
Molecular Weight:248.707
Hs Code.:
DSSTox Substance ID:DTXSID40515668

Synonyms:dimethyl 1-(chloromethyl)cyclohexane-1,2-dicarboxylate;85750-78-3;DTXSID40515668

Suppliers and Price of Dimethyl 1-(chloromethyl)cyclohexane-1,2-dicarboxylate

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Business phase:: The product has achieved commercial mass production^*data from LookChem market partment

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Chemical Property of Dimethyl 1-(chloromethyl)cyclohexane-1,2-dicarboxylate

Chemical Property:

XLogP3:1.9
Hydrogen Bond Donor Count:0
Hydrogen Bond Acceptor Count:4
Rotatable Bond Count:5
Exact Mass:248.0815367
Heavy Atom Count:16
Complexity:279

Purity/Quality:

Safty Information:

Pictogram(s):
Hazard Codes:

MSDS Files:: SDS file from LookChem

Useful:

Canonical SMILES:COC(=O)C1CCCCC1(CCl)C(=O)OC

Technology Process of Dimethyl 1-(chloromethyl)cyclohexane-1,2-dicarboxylate

There total 1 articles about Dimethyl 1-(chloromethyl)cyclohexane-1,2-dicarboxylate 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:

: 67-56-1
methanol

: 85739-44-2
1-(chloromethyl)cyclohexane-1,2-dicarboxylic anhydride

: 85750-78-3
dimethyl 1-(chloromethyl)cyclohexane-1,2-dicarboxylate

Guidance literature:: With thionyl chloride; In methanol;
DOI:10.1016/0040-4039(82)80136-6

Reference yield:

: 85750-78-3
dimethyl 1-(chloromethyl)cyclohexane-1,2-dicarboxylate

: 85739-42-0
C₂₇H₂₄O

Guidance literature:: Multi-step reaction with 4 steps

1: NaOMe / benzene / 8 h / Heating

2: 70 percent / aq. KOH / methanol / Heating

3: 1.) HgO, MgSO₄, 2.) Br₂ / 1.) CH₂Cl₂, reflux, 15 min, 2.) CH₂Cl₂, reflux, 3.5 h

4: 71 percent / tert-BuLi / tetrahydrofuran; pentane / 0.5 h / -78 °C

With potassium hydroxide; bromine; tert.-butyl lithium; sodium methylate; magnesium sulfate; mercury(II) oxide; In tetrahydrofuran; methanol; pentane; benzene;
DOI:10.1021/ja00021a024

Reference yield:

: 85750-78-3
dimethyl 1-(chloromethyl)cyclohexane-1,2-dicarboxylate

: 135663-40-0
2-(1-bicyclo<4.1.0>heptyl)cyclohexene-1-carboxaldehyde

Guidance literature:: Multi-step reaction with 4 steps

1: NaOMe / benzene / 8 h / Heating

2: 70 percent / aq. KOH / methanol / Heating

3: 47 percent / I₂, iodosobenzene diacetate (IBDA) / cyclohexane / 4.5 h / Heating; Irradiation

4: 1.) MeLi, 2.) MeOH / 1.) Et₂O, -78 deg C, 5 h, 2.) Et₂O, from -78 deg C to RT

With methanol; potassium hydroxide; [bis(acetoxy)iodo]benzene; methyllithium; iodine; sodium methylate; In methanol; cyclohexane; benzene;
DOI:10.1021/ja00021a024