Triacontanoic acid

Base Information

• Chemical Name: Triacontanoic acid
• CAS No.: 506-50-3
• Molecular Formula: C30H60 O2
• Molecular Weight: 452.805
• Hs Code.: 2915900090
• European Community (EC) Number: 208-042-3
• NSC Number: 53832
• UNII: HLT2OTQ105
• DSSTox Substance ID: DTXSID7075052
• Nikkaji Number: J96.090J
• Wikipedia: Melissic_acid
• Wikidata: Q420731
• Metabolomics Workbench ID: 51
• Mol file: 506-50-3.mol

Synonyms:TRIACONTANOIC ACID;Melissic acid;506-50-3;n-Triacontanoic acid;1-Triacontanoic acid;myricic acid;triacontoic acid;Melissic acid A;Melissic acid,synthetic;TRIACONTANOICACID;UNII-HLT2OTQ105;HLT2OTQ105;CH3-[CH2]28-COOH;C30H60O2;EINECS 208-042-3;NSC 53832;NSC-53832;C30:0;Melissinsaure;Triacontansaeure;MFCD00002813;Melissic acid, >=98%;SCHEMBL133806;DTXSID7075052;CHEBI:31003;HY-N8451;NSC53832;LMFA01010030;AKOS003367977;FA 30:0;AS-57048;FA(30:0);CS-0144272;FT-0628192;M0595;T72541;A855124;Q420731;0A718695-87D8-4BEA-B629-727FBD395462

Chemical Property of Triacontanoic acid

Chemical Property:

• Appearance/Colour: slightly yellow fluffy crystalline powder
• Vapor Pressure: 1.44E-08mmHg at 25°C
• Melting Point: 92-94 °C(lit.)
• Refractive Index: 1.4838 (estimate)
• Boiling Point: 441.4°Cat760mmHg
• PKA: 4.78±0.10(Predicted)
• Flash Point: 196.9°C
• PSA: 37.30000
• Density: 0.873g/cm³
• LogP: 11.01370
• Storage Temp.: 2-8°C
• Solubility.: chloroform: soluble25mg/mL, clear, colorless to faintly yellow
• XLogP3: 13.9
• Hydrogen Bond Donor Count: 1
• Hydrogen Bond Acceptor Count: 2
• Rotatable Bond Count: 28
• Exact Mass: 452.45933115
• Heavy Atom Count: 32
• Complexity: 353

Purity/Quality:

98%,99%, ^*data from raw suppliers

TriacontanoicAcid ^*data from reagent suppliers

Safty Information:

• Safety Statements: 24/25

MSDS Files:

SDS file from LookChem

Useful:

• Chemical Classes: Other Classes -> Organic Acids
• Canonical SMILES: CCCCCCCCCCCCCCCCCCCCCCCCCCCCCC(=O)O
• Uses: Biochemical research. Triacontanoic Acid has agricultural applications and is a useful compound in the removal of residual pesticides from fruit via ozone-microbubble treatment. Melissic acid was used in a study on identification and determination of very-long-chain polyunsaturated fatty acid in freshwater crustacean species Bathynella natans.

Technology Process of Triacontanoic acid

There total 29 articles about Triacontanoic acid 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: 99.9%

methyl 1-triacontanoate (629-83-4) → melissic acid (506-50-3)

Guidance literature:

With potassium hydroxide; In methanol; water; 1.) 50 deg C, 6 h, 2.) RT, 15 h;

Reference yield: 67.0%

hentriacontanol (544-86-5) → melissic acid (506-50-3)

Guidance literature:

With potassium permanganate; adogen 464; trialkylammonium chloride; acetic acid; In dichloromethane; water; Heating;

DOI:10.1016/S0040-4020(01)85609-X

Reference yield:

stigmast-5-en-3β-O-(2'-O-n-triacontanoyl)-β-D-glucopyranoside (1380446-38-7) → β-D-glucose (492-61-5) + melissic acid (506-50-3) + β-sitosterol (83-46-5)

Guidance literature:

With water; potassium hydroxide; for 2h; Reflux;

DOI:10.1080/10286020.2011.653346

upstream raw materials:

melissyl alcohol

12-oxo-triacontanoic acid

11-oxo-triacontanoic acid

13-oxo-triacontanoic acid

Downstream raw materials:

melissyl alcohol

n-triacontyl acetate

C₈₄H₁₄₄O₁₄Si₂

Ethyl tricontanoate

Refernces

• 1、 Gupta, Madan M.,Lal, Ram N.,Shukla, Yogendra N.. "ALIPHATIC HYDROXYKETONES AND DIOSGENIN FROM COSTUS SPECIOSUS ROOTS". . p. 2553 - 2556. Retrieved 1981.
• 2、 Singh, Pahup,Khandelwal, Poonam,Sharma, Kuldeep K.,Sharma. "Cetyl triacontanoate and other constituents from Acacia jacquemontii and Kigelia pinnata". body text. p. 1403 - 1407. Retrieved 2011/09/20.
• 3、 Brown, Herbert C.,Iyer, Ramakrishnan R.,Bhat, Narayan G.,Racherla, Uday S.,Brown, Charles A.. "Organoboranes for synthesis. 13. Simple, efficient syntheses of long-chain alcohols and carboxylic acids". . p. 9187 - 9194. Retrieved 2007/10/02.