Cyclohexanecarboxylic acid, 4-methyl-, methyl ester

Base Information

Chemical Name:Cyclohexanecarboxylic acid, 4-methyl-, methyl ester
CAS No.:51181-40-9
Molecular Formula:C9H16O2
Molecular Weight:156.225
Hs Code.:2916209090
European Community (EC) Number:803-922-9
UNII:AF768W8UFN,D64N86PC8X
DSSTox Substance ID:DTXSID3068623
Nikkaji Number:J100.818H,J785.078F,J785.079D
Wikidata:Q27276149
Mol file:51181-40-9.mol

Synonyms:51181-40-9;Cyclohexanecarboxylic acid, 4-methyl-, methyl ester;Methyl 4-methylcyclohexanecarboxylate;methyl 4-methylcyclohexane-1-carboxylate;MMCHC;41076-10-2;AF768W8UFN;Methyl 4-methylcyclohexanecarboxylate, cis-;Cyclohexanecarboxylic acid, 4-methyl-, methyl ester, cis-;UNII-AF768W8UFN;SCHEMBL255285;SCHEMBL764832;D64N86PC8X;DTXSID3068623;SCHEMBL12262687;SCHEMBL13783334;SCHEMBL14424491;UNII-1678W73A68;AKOS017518257;cis-methyl 4-methylcyclohexanecarboxylate;trans-methyl 4-methylcyclohexanecarboxylate;1678W73A68;Methyl 4-methylcyclohexanecarboxylate, trans-;4-Methylcyclohexanecarboxylic acid methyl ester;Q27273904;Q27276149;trans-4-methyl-cyclohexanecarboxylic acid. Methyl ester;4alpha-Methylcyclohexane-1alpha-carboxylic acid methyl ester;4alpha-Methylcyclohexane-1beta-carboxylic acid methyl ester;Cyclohexanecarboxylic acid, 4-methyl-, methyl ester, trans-

Suppliers and Price of Cyclohexanecarboxylic acid, 4-methyl-, methyl ester

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-MethylcyclohexanecarboxylicAcidMethylEster
1g
$ 185.00

Medical Isotopes, Inc.
4-Methylcyclohexanecarboxylicacidmethylester
10 g
$ 2200.00

Medical Isotopes, Inc.
4-Methylcyclohexanecarboxylicacidmethylester
1 g
$ 650.00

Total 7 raw suppliers

Chemical Property of Cyclohexanecarboxylic acid, 4-methyl-, methyl ester

Chemical Property:

Vapor Pressure:0.508mmHg at 25°C
Boiling Point:191.7°Cat760mmHg
Flash Point:66.3°C
PSA：26.30000
Density:0.952g/cm³
LogP:1.98570
Storage Temp.:Refrigerator
Solubility.:Chloroform (Slightly), Ethyl Acetate (Slightly)
XLogP3:2.4
Hydrogen Bond Donor Count:0
Hydrogen Bond Acceptor Count:2
Rotatable Bond Count:2
Exact Mass:156.115029749
Heavy Atom Count:11
Complexity:135

Purity/Quality:

98%Min ^*data from raw suppliers

4-MethylcyclohexanecarboxylicAcidMethylEster ^*data from reagent suppliers

Safty Information:

Pictogram(s):
Hazard Codes:

MSDS Files:: SDS file from LookChem

Useful:

Canonical SMILES:CC1CCC(CC1)C(=O)OC
Uses 4-Methylcyclohexanecarboxylic Acid Methyl Ester is the methyl ester derivative of 4-Methyl-cyclohexanecarboxylic Acid (M299530) and is used as a starting material in many organic reactions.

Technology Process of Cyclohexanecarboxylic acid, 4-methyl-, methyl ester

There total 18 articles about Cyclohexanecarboxylic acid, 4-methyl-, methyl ester 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: 83.0%

: 67-56-1
methanol

: 4331-54-8
4-methylcyclohexanecarboxylic acid

: 51181-40-9
methyl 4-methyl-1-cyclohexanecarboxylate

Guidance literature:: With thionyl chloride; In neat (no solvent); at 0 - 25 ℃; for 16h; Temperature; Inert atmosphere;

Reference yield:

: 120-61-6
1,4-benzenedicarboxylic acid dimethyl ester

: 94-60-0
dimethyl 1,4-cyclohexane dicarboxylate

: 105-08-8
bis-1,4-(hydroxymethyl)cyclohexane

: 51181-40-9
methyl 4-methyl-1-cyclohexanecarboxylate

: 34885-03-5
(4-methylcyclohexyl)methanol

Guidance literature:: With hydrogen; Ru₅PtSn; silica gel; In ethanol; at 119.85 ℃; for 8h; under 30002.4 Torr; Further byproducts given;
DOI:10.1002/anie.200600359

Reference yield:

: 120-61-6
1,4-benzenedicarboxylic acid dimethyl ester

: 94-60-0
dimethyl 1,4-cyclohexane dicarboxylate

: 51181-40-9
methyl 4-methyl-1-cyclohexanecarboxylate

: 34885-03-5
(4-methylcyclohexyl)methanol

Guidance literature:: With hydrogen; Ru₆Sn; silica gel; In ethanol; at 99.85 ℃; for 8h; under 15001.2 Torr; Further Variations:; Catalysts; reaction times; Product distribution;
DOI:10.1002/1521-3773(20011217)40:24<4638::AID-ANIE4638>3.0.CO;2-W