Tridecanal

Base Information

• Chemical Name: Tridecanal
• CAS No.: 10486-19-8
• Molecular Formula: C13H26O
• Molecular Weight: 198.349
• Hs Code.: 2912190090
• European Community (EC) Number: 234-004-0
• UNII: 193923TA82
• DSSTox Substance ID: DTXSID4021682
• Nikkaji Number: J97.278I
• Wikidata: Q18456293
• Metabolomics Workbench ID: 3472
• ChEMBL ID: CHEMBL2228568
• Mol file: 10486-19-8.mol

Synonyms:Aldehyde13-13;Tridecanaldehyde;Tridecyl aldehyde;n-Tridecanal;n-Tridecylaldehyde;

Chemical Property of Tridecanal

Chemical Property:

• Appearance/Colour: clear faint yellow liquid.
• Vapor Pressure: 3.25E-11mmHg at 25°C
• Melting Point: 15 ºC
• Refractive Index: n20/D 1.437(lit.)
• Boiling Point: 257.3 °C at 760 mmHg
• Flash Point: 112 °C
• PSA: 17.07000
• Density: 0.824 g/cm³
• LogP: 4.49630
• Storage Temp.: Refrigerator
• Sensitive.: Air Sensitive
• Water Solubility.: Insoluble in water
• XLogP3: 5.4
• Hydrogen Bond Donor Count: 0
• Hydrogen Bond Acceptor Count: 1
• Rotatable Bond Count: 11
• Exact Mass: 198.198365449
• Heavy Atom Count: 14
• Complexity: 110

Purity/Quality:

98%, ^*data from raw suppliers

Tridecanal >95.0%(GC) ^*data from reagent suppliers

Safty Information:

• Pictogram(s): Xi
• Hazard Codes: Xi
• Statements: 36/37/38
• Safety Statements: 26

MSDS Files:

SDS file from LookChem

Total 1 MSDS from other Authors

Useful:

• Chemical Classes: Other Classes -> Aldehydes
• Canonical SMILES: CCCCCCCCCCCCC=O
• Uses: Tridecanal is a model compound in the nonradioactive assay/RP-HPLC-fluorescence analysis of aliphatic aldehydes employing the Hantzsch reaction.

Technology Process of Tridecanal

There total 64 articles about Tridecanal 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: 100.0%

tridecan-1-ol (112-70-9) → tridecanal (10486-19-8)

Guidance literature:

tridecan-1-ol; With oxalyl dichloride; dimethyl sulfoxide; In dichloromethane; at -60 ℃; for 1.5h;

With triethylamine; In dichloromethane; at -60 ℃; for 0.5h;

DOI:10.1021/acs.orglett.5b00826

Reference yield: 98.0%

1-dodecene (112-41-4,25067-08-7,62132-67-6) + carbon monoxide (201230-82-2) → tridecanal (10486-19-8)

Guidance literature:

With hydrogen; In cyclohexane; at 120 ℃; for 4h; under 37503.8 Torr; Autoclave;

DOI:10.1007/s10562-012-0841-1

Reference yield: 97.0%

1,1-Diethoxytridecan (72934-16-8) → tridecanal (10486-19-8)

Guidance literature:

With calcium chloride; In 1,4-dioxane; water; at 19.85 - 179.85 ℃; for 0.666667h; under 7575.61 Torr;

DOI:10.1016/j.tetlet.2003.09.087

upstream raw materials:

2-hydroxytetradecanoic acid

pentadec-2-enoic acid

laurylmagnesium bromide

1,6-dimethyl-3-p-tolyl-3,4-dihydro-quinazolinium; iodide

Downstream raw materials:

[1-(tert-butyl-dimethyl-silanyloxymethyl)-2-(tert-butyl-diphenyl-silanyloxy)-3-oxo-heptadec-4-enyl]-carbamic acid tert-butyl ester

C₃₇H₄₇NO₂

1-hydroxytridecylbenzene

C₃₂H₄₅NO₅

Refernces

• 1、 Potier, Jonathan,Menuel, Stephane,Chambrier, Marie-Heleine,Burylo, Laurence,Blach, Jean-Francois,Woisel, Patrice,Monflier, Eric,Hapiot, Frederic. "Pickering emulsions based on supramolecular hydrogels: Application to higher olefins' hydroformylation". . p. 1618 - 1621. Retrieved 2013.
• 2、 Tang, Xinxin,Jia, Xiangqing,Huang, Zheng. "Thermal, Catalytic Conversion of Alkanes to Linear Aldehydes and Linear Amines". . p. 4157 - 4163. Retrieved 2018.
• 3、 Sun, Qi,Dai, Zhifeng,Liu, Xiaolong,Sheng, Na,Deng, Feng,Meng, Xiangju,Xiao, Feng-Shou. "Highly efficient heterogeneous hydroformylation over rh-metalated porous organic polymers: Synergistic effect of high ligand concentration and flexible framework". . p. 5204 - 5209. Retrieved 2015.
• 4、 Fukuyama, Takahide,Rahman, Md. Taifur,Kamata, Naoya,Ryu, Ilhyong. "Radical carbonylations using a continuous microflow system". . . Retrieved 2009.
• 5、 Yuan, Maolin,Fu, Haiyan,Li, Ruixiang,Chen, Hua,Li, Xianjun. "Synthesis of the novel ligand tris-(3,4-dimethoxylphenyl) phosphine and its catalytic performance in 1-dodecene hydroformylation". . p. 1093 - 1097. Retrieved 2010.
• 6、 Fales. "-". . p. 5118,5120. Retrieved 1955.
• 7、 Jin, Xin,Yang, Daoxing,Xu, Xinfu,Yang, Zhiqiang. "Super long-term highly active and selective hydroformylation in a room temperature-solidifiable guanidinium ionic liquid with a polyether tag". . p. 9017 - 9019,3. Retrieved 2012.
• 8、 Potier, Jonathan,Menuel, Stephane,Monflier, Eric,Hapiot, Frederic. "Synergetic effect of randomly methylated β-cyclodextrin and a supramolecular hydrogel in Rh-catalyzed hydroformylation of higher olefins". . p. 2342 - 2346. Retrieved 2014.
• 9、 Webb, Paul B.,Sellin, Murielle F.,Kunene, Thulani E.,Williamson, Sylvia,Slawin, Alexandra M. Z.,Cole-Hamilton, David J.. "Continuous Flow Hydroformylation of Alkenes in Supercritical Fluid-Ionic Liquid Biphasic Systems". . p. 15577 - 15588. Retrieved 2003.
• 10、 Xu, Yicheng,Wang, Yanhua,Zeng, Yan,Jiang, Jingyang,Jin, Zilin. "A novel thermoregulated ionic liquid and organic biphasic system with rh nanoparticles for olefin hydroformylation". . p. 914 - 919. Retrieved 2012.