Methyl Stearate

Base Information

• Chemical Name: Methyl Stearate
• CAS No.: 112-61-8
• Deprecated CAS: 172226-13-0,172226-14-1,218433-32-0,172226-14-1,218433-32-0
• Molecular Formula: C19H38O2
• Molecular Weight: 298.51
• Hs Code.: H3(CH2)16COOCH3 MOL WT. 298.51
• European Community (EC) Number: 203-990-4
• NSC Number: 9418
• UNII: 8D4NXF3ZH7
• DSSTox Substance ID: DTXSID2047640
• Nikkaji Number: J1.997F
• Wikidata: Q27137527
• NCI Thesaurus Code: C77478
• RXCUI: 1363574
• Metabolomics Workbench ID: 4119
• Mol file: 112-61-8.mol

Synonyms:METHYL STEARATE;Methyl octadecanoate;112-61-8;Octadecanoic acid, methyl ester;Stearic acid methyl ester;Stearic acid, methyl ester;Metholene 2218;Kemester 9718;Methyl n-octadecanoate;Kemester 9018;Methyl Stearate-1-13C;Emery 2218;n-Octadecanoic acid methyl ester;METHYLSTEARATE;NSC 9418;HSDB 2901;UNII-8D4NXF3ZH7;Methyl-d3Stearate;EINECS 203-990-4;8D4NXF3ZH7;OCTADECANOIC ACID,METHYL ESTER;BRN 1786213;Kemester 4516;AI3-07960;NSC-9418;MFCD00009005;DTXSID2047640;Methyl ester of octadecanoic acid;n-Octadecanoic acid, methyl ester;EC 203-990-4;4-02-00-01216 (Beilstein Handbook Reference);WE(1:0/18:0);METHYL STEARATE (II);METHYL STEARATE [II];METHYL STEARATE (USP-RS);METHYL STEARATE [USP-RS];Starate de mthyle;STEARATE, METHYL;C18 FAME;PASTELL M 180;SCHEMBL39262;octadecanoic acid methyl ester;Octadecanoic acid-methyl ester;METHYL STEARATE [HSDB];METHYL STEARATE [INCI];WLN: 17VO1;DTXCID0027640;Methyl stearate, >=96%, FG;Methyl stearate, ~99% (GC);CHEBI:69188;NSC9418;CS-D1357;HY-B1934;Methyl stearate, analytical standard;LMFA07010474;s5756;STL281377;AKOS015901560;STEARIC ACID METHYL ESTER [MI];AC-35013;BS-43767;SY027457;methyl stearate [standard material for gc];LS-146687;Octadecanoic acid methyl ester (FAME MIX);FT-0628807;FT-0672122;S0080;S0312;A894565;4-METHOXY-BENZENECARBODITHIOICACIDMETHYLESTER;J-010357;W-108643;Q27137527;6A62CF35-4D1C-47C0-8186-CAB436C59C3F;Methyl stearate, certified reference material, TraceCERT(R);Methyl stearate, European Pharmacopoeia (EP) Reference Standard;Methyl stearate, United States Pharmacopeia (USP) Reference Standard

Chemical Property of Methyl Stearate

Chemical Property:

• Appearance/Colour: White crystals or chunky solid
• Vapor Pressure: 3.11E-05mmHg at 25°C
• Melting Point: 37-41 °C(lit.)
• Refractive Index: NFPA RATINGS
• Boiling Point: 355.5 °C at 760 mmHg
• Flash Point: 169.3 °C
• PSA: 26.30000
• Density: 0.863 g/cm³
• LogP: 6.42090
• XLogP3: 9
• Hydrogen Bond Donor Count: 0
• Hydrogen Bond Acceptor Count: 2
• Rotatable Bond Count: 17
• Exact Mass: 298.287180451
• Heavy Atom Count: 21
• Complexity: 214

Purity/Quality:

99% ^*data from raw suppliers

Safty Information:

• Safety Statements: S24/25:Avoid contact with skin and eyes.

MSDS Files:

SDS file from LookChem

Total 1 MSDS from other Authors

Useful:

• Chemical Classes: Other Classes -> Stearates
• Canonical SMILES: CCCCCCCCCCCCCCCCCC(=O)OC

Technology Process of Methyl Stearate

There total 156 articles about Methyl Stearate 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:

cis-Octadecenoic acid (112-80-1,2027-47-6) → naphthalene (91-20-3,71998-51-1,72931-45-4) + propene (187737-37-7,13987-01-4,15220-87-8,9003-07-0,676-63-1,25085-53-4) + octadecan-2-one (7373-13-9) + ethene (74-85-1) + Methyl stearate (112-61-8) + o-xylene (95-47-6) + 2-Ethyltoluene (611-14-3) + para-xylene (106-42-3) + ethylbenzene (100-41-4,27536-89-6) + tetramethyl-3,4,5,6 octane (62185-21-1) + 1-Methylnaphthalene (90-12-0,34475-76-8) + toluene (108-88-3,15644-74-3,16713-13-6)

Guidance literature:

With mesoporous ZSM-5 zeolite with pore size of about 16nm; at 550 ℃; Temperature; Catalytic behavior;

DOI:10.1016/j.apcata.2019.02.011

Reference yield:

methanol (67-56-1) → methyl (7Z,10Z,13Z,16Z,19Z)-docosa-7,10,13,16,19-pentaenoate (108698-02-8) + methyl vaccenate (1937-63-9,52380-33-3,6198-58-9) + methyl linoleate (16326-32-2) + methyl arachidonate (2566-89-4) + (Z)-9-hexadecenoic acid methyl ester (1120-25-8,3913-63-1) + Methyl oleate (112-62-9) + Methyl linoleate (112-63-0) + (11Z)-11-icosenoic acid methyl ester (2390-09-2,3946-08-5) + methyl linolenate (301-00-8) + methyl n-dodecanoate (111-82-0) + methyl myristoate (124-10-7) + pentadecanoic acid methyl ester (7132-64-1) + hexadecanoic acid methyl ester (112-39-0) + methyl margarate (1731-92-6) + Methyl stearate (112-61-8) + methyl arachidate (1120-28-1) + behenic acid methyl ester (929-77-1) + all-cis-8,11,14-eicosatrienoic acid methyl ester (21061-10-9) + (5Z,8Z,11Z,14Z,17Z)-5,8,11,14,17-icosapentaenoic acid methyl ester (2734-47-6) + cis,cis,cis,cis-Docosa-7,10,13,16-tetraensaeuremethylester (13487-42-8) + myristoleic acid methyl ester (56219-06-8) + cis,trans-9,11-methyloctadecadienoate (35042-75-2)

Guidance literature:

With potassium hydroxide; water; In methanol; at 55 ℃; for 1.5h;

methanol; With sulfuric acid; In water; at 20 - 55 ℃; for 1.5h; Product distribution / selectivity;

Reference yield:

methanol (67-56-1) + soybean oil (8001-22-7) → methyl trans-2-octadecenoate (14663-11-7) + 5,8,11-Eicosatrienoic acid, methyl ester + heneicosapentaenoic acid methyl ester + eicosadienoic acid methyl ester (88400-02-6) + docosapentaenoic acid methyl ester + docosatetraenoic acid methyl ester + docosadienoic acid methyl ester + palmitelaidic acid methyl ester (10030-74-7,3913-63-1) + Methyl oleate (112-62-9) + Methyl linoleate (112-63-0) + methyl cis-13-docosenoate (1120-34-9) + methyl cis-tetracos-15-enate (2733-88-2) + methyl myristoate (124-10-7) + hexadecanoic acid methyl ester (112-39-0) + methyl margarate (1731-92-6) + Methyl stearate (112-61-8) + methyl arachidate (1120-28-1) + behenic acid methyl ester (929-77-1) + methyl tetracosanoate (2442-49-1) + methyl (2E)-eicosenoate (10305-59-6) + methyl (9Z,12Z,15E)-octadeca-9,12,15-trienoate (37929-05-8) + glycerol (56-81-5,25618-55-7,64333-26-2,8013-25-0)

Guidance literature:

With potassium hydroxide; at 48 - 52 ℃; for 4h;

upstream raw materials:

methanol

1,2-bis-stearoylmercapto-ethane

sodium methylate

Methyl oleate

Downstream raw materials:

stearic acid furfuryl ester

8-<3-Ethoxycarbonyl-2-octyl-1-cyclopropenyl>-octansaeure-methylester

2-O-benzyl-1,3-di-O-stearoyl-rac-glycerol

1,1-diphenyl-1-octadecanol

Refernces

• 1、 Philippaerts, An,Paulussen, Sabine,Turner, Stuart,Lebedev, Oleg I.,Van Tendeloo, Gustaaf,Poelman, Hilde,Bulut, Metin,De Clippel, Filip,Smeets, Pieter,Sels, Bert,Jacobs, Pierre. "Selectivity in sorption and hydrogenation of methyl oleate and elaidate on MFI zeolites". . p. 172 - 184. Retrieved 2010.
• 2、 Siddiqui, Bina S.,Firdous,Begum, Sabira. "A new reagent for the methylation of carboxyl groups". . p. 9059 - 9060. Retrieved 2001.
• 3、 Sinsheimer et al.. "". . p. 622,624. Retrieved 1970.
• 4、 Addae-Mensah, Ivan,Waibel, Reiner,Asunka, Stephen A.,Oppong, Isaac V.,Achenbach, Hans. "The dichapetalins - A new class of triterpenoids". . p. 649 - 656. Retrieved 1996.
• 5、 Krupickova, Jana,Vcelak, Jaroslav,Hetflejs, Jiri. "HYDROGENATION OF FATTY ACIDS ESTERS. III. HYDROGENATION OF METHYL (9Z,12Z)-OCTADECADIENOATE AND METHYL (9Z,12Z,15Z)-OCTADECATRIENOATE". . p. 2593 - 2604. Retrieved 1992.
• 6、 Carvalho, Myller S.,Mendonc?a, Ma?rcio A.,Pinho, David M. M.,Resck, Ine?s S.,Suarez, Paulo A. Z.. "Chromatographic analyses of fatty acid methyl esters by HPLC-UV and GC-FID". . p. 763 - 769. Retrieved 2012.
• 7、 Pei-Wu, Geng,Fukuyama, Yoshiyasu,Rei, Wang,Jinxian, Bao,Nakagawa,Kazuyuki. "AN ACYLATED SITOSTEROL GLUCOSIDE FROM ALISMA PLANTAGO-AQUATICA". . p. 1895 - 1896. Retrieved 1988.
• 8、 Gunstone et al.. "". . p. 71,80. Retrieved 1974.
• 9、 Curran, Dennis P.,Hadida, Sabine. "Tris(2-(perfluorohexyl)ethyl)tin hydride: A new fluorous reagent for use in traditional organic synthesis and liquid phase combinatorial synthesis". . p. 2531 - 2532. Retrieved 1996.
• 10、 Ango, Yves P.,Kapche, Gilbert D. W. F.,Kuete, Victor,Mapitse, Renameditswe,Yeboah, Samuel O.,Ngadjui, Bonaventure T.. "Three New Derivatives and Others Constituents from the Roots and Twigs of Trilepisium?madagascariense DC". . p. 642 - 649. Retrieved 2016.