Methyl 4-cyclohexylbenzoate

Base Information

Chemical Name:Methyl 4-cyclohexylbenzoate
CAS No.:92863-34-8
Molecular Formula:C14H18 O2
Molecular Weight:218.296
Hs Code.:2916399090
DSSTox Substance ID:DTXSID30443421
Nikkaji Number:J3.395.283J
Wikidata:Q82261221
Mol file:92863-34-8.mol

Synonyms:Methyl 4-cyclohexylbenzoate;92863-34-8;4-Cyclohexyl-benzoic acid methyl ester;Methyl4-cyclohexylbenzoate;methyl-4-cyclohexylbenzoate;SCHEMBL1790000;DTXSID30443421;KBYPGJLXPWNMCE-UHFFFAOYSA-N;STL444359;AKOS015961252;4-CYCLOHEXYL-BENZOICACIDMETHYLESTER;AC-13414;FT-0628632

Suppliers and Price of Methyl 4-cyclohexylbenzoate

Supply Marketing:

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

Manufacturers and distributors:

Manufacture/Brand
Chemicals and raw materials
Packaging
price

TRC
4-Cyclohexyl-benzoicAcidmethylester
50mg
$ 200.00

Crysdot
Methyl4-cyclohexylbenzoate 95+%
10g
$ 476.00

Chemenu
methyl4-cyclohexylbenzoate 95%
10g
$ 450.00

American Custom Chemicals Corporation
4-CYCLOHEXYL-BENZOIC ACID METHYL ESTER 95.00%
5MG
$ 505.57

Alichem
Methyl4-cyclohexylbenzoate
5g
$ 226.01

Total 8 raw suppliers

Chemical Property of Methyl 4-cyclohexylbenzoate

Chemical Property:

Vapor Pressure:0mmHg at 25°C
Refractive Index:1.525
Boiling Point:323.632°C at 760 mmHg
Flash Point:144.708°C
PSA：26.30000
Density:1.047g/cm³
LogP:3.52090
Storage Temp.:2-8°C
XLogP3:4.9
Hydrogen Bond Donor Count:0
Hydrogen Bond Acceptor Count:2
Rotatable Bond Count:3
Exact Mass:218.130679813
Heavy Atom Count:16
Complexity:223

Purity/Quality:

98%Min ^*data from raw suppliers

4-Cyclohexyl-benzoicAcidmethylester ^*data from reagent suppliers

Safty Information:

Pictogram(s):
Hazard Codes:
Safety Statements: S22:Do not inhale dust.; S24/25:Avoid contact with skin and eyes.;

MSDS Files:: SDS file from LookChem

Useful:

Canonical SMILES:COC(=O)C1=CC=C(C=C1)C2CCCCC2

Technology Process of Methyl 4-cyclohexylbenzoate

There total 29 articles about Methyl 4-cyclohexylbenzoate 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: 99.0%

: 619-42-1
4-methoxycarbonylphenyl bromide

: 446065-11-8
cyclohexyltrifluoro-λ⁴-borane potassium salt

: 92863-34-8
4-cyclohexylbenzoic acid methyl ester

Guidance literature:: With [4,4′-bis(1,1-dimethylethyl)-2,2′-bipyridine]nickel(II) dichloride; [4,4′-bis(1,1-dimethylethyl)-2,2′-bipyridine-N1,N1′]bis{3,5-difluoro-2-[5-(trifluoromethyl)-2-pyridinyl-κN]phenyl-κC}iridium(III) hexafluorophosphate; caesium carbonate; In 1,4-dioxane; at 20 ℃; for 16h; Glovebox; Sealed tube; Irradiation;
DOI:10.1021/acs.joc.1c01867

Reference yield: 97.0%

: 67-56-1
methanol

: 20029-52-1
4-cyclohexylbenzoic acid

: 92863-34-8
4-cyclohexylbenzoic acid methyl ester

Guidance literature:: With sulfuric acid; for 15h; Heating;
DOI:10.1080/00397919708006827

Reference yield: 92.0%

: 619-42-1
4-methoxycarbonylphenyl bromide

: 1-cyclohexyl-2,4,6-triphenylpyridin-1-ium tetrafluoroborate salt

: 92863-34-8
4-cyclohexylbenzoic acid methyl ester

Guidance literature:: With nickel(II) bromide dimethoxyethane; manganese; 4,4'-Dimethoxy-2,2'-bipyridin; In 1-methyl-pyrrolidin-2-one; at 20 ℃; for 20h; Reagent/catalyst; Solvent; chemoselective reaction; Catalytic behavior; Inert atmosphere;
DOI:10.1021/acs.orglett.9b01016