Cyclohexylideneacetyl chloride

Base Information Edit

Chemical Name:Cyclohexylideneacetyl chloride
CAS No.:80385-43-9
Molecular Formula:C8H11ClO
Molecular Weight:158.628
Hs Code.:
DSSTox Substance ID:DTXSID60506755
Nikkaji Number:J789.075C
Mol file:80385-43-9.mol

Synonyms:cyclohexylideneacetyl chloride;80385-43-9;2-cyclohexylideneacetyl chloride;SCHEMBL10938675;DTXSID60506755;POFHGVAOSUKEPE-UHFFFAOYSA-N

Suppliers and Price of Cyclohexylideneacetyl chloride

Supply Marketing:Edit

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

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Chemical Property of Cyclohexylideneacetyl chloride Edit

Chemical Property:

XLogP3:2.8
Hydrogen Bond Donor Count:0
Hydrogen Bond Acceptor Count:1
Rotatable Bond Count:1
Exact Mass:158.0498427
Heavy Atom Count:10
Complexity:153

Purity/Quality:

Safty Information:

Pictogram(s):
Hazard Codes:

MSDS Files:: SDS file from LookChem

Useful:

Canonical SMILES:C1CCC(=CC(=O)Cl)CC1

Technology Process of Cyclohexylideneacetyl chloride

There total 5 articles about Cyclohexylideneacetyl chloride 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:

: 1552-91-6
cyclohexylideneacetic acid

: 80385-43-9
2-cyclohexylideneacetyl chloride

Guidance literature:: With thionyl chloride;

Reference yield:

: 108-94-1,11119-77-0,9003-41-2,9075-99-4
cyclohexanone

: 80385-43-9
2-cyclohexylideneacetyl chloride

Guidance literature:: Multi-step reaction with 3 steps

1.1: sodium hydride / tetrahydrofuran; mineral oil / 1 h / 0 - 20 °C / Inert atmosphere; Cooling with ice

1.2: 4 h / 20 °C

2.1: potassium hydroxide / ethanol; water / 90 °C

3.1: oxalyl dichloride; N,N-dimethyl-formamide / dichloromethane / 3.58 h / 0 - 20 °C

With oxalyl dichloride; sodium hydride; N,N-dimethyl-formamide; potassium hydroxide; In tetrahydrofuran; ethanol; dichloromethane; water; mineral oil;
DOI:10.1021/jacs.5b13353

Reference yield:

: 1552-92-7
ethyl cyclohexylideneacetate

: 80385-43-9
2-cyclohexylideneacetyl chloride

Guidance literature:: With potassium hydroxide; oxalyl dichloride; Yield given. Multistep reaction; 1.) EtOH, H₂O, reflux, 5 h, 2.) C₆H₆, 0 deg C, 1 h;
DOI:10.1016/S0040-4020(98)00939-9