2-Nonadecanone

Base Information

• Chemical Name: 2-Nonadecanone
• CAS No.: 629-66-3
• Molecular Formula: C19H38O.
• Molecular Weight: 282.51
• European Community (EC) Number: 211-102-1
• DSSTox Substance ID: DTXSID70212077
• Nikkaji Number: J43.190G
• Wikidata: Q27160551
• Metabolomics Workbench ID: 5457
• Mol file: 629-66-3.mol

Synonyms:2-Nonadecanone;Nonadecan-2-one;629-66-3;nonadeca-2-one;Methyl heptadecyl ketone;EINECS 211-102-1;AI3-36474;Heptadecyl methyl ketone;SCHEMBL162684;CHEBI:88668;DTXSID70212077;LMFA12000051;MFCD00026671;CS-0362556;FT-0632669;F87377;Q27160551

Chemical Property of 2-Nonadecanone

Chemical Property:

• Appearance/Colour: Fine white plates.
• Vapor Pressure: 0.000137mmHg at 25°C
• Melting Point: 54-56 °C
• Refractive Index: 1.443
• Boiling Point: 343.8 °C at 760 mmHg
• Flash Point: 73.9 °C
• PSA: 17.07000
• Density: 0.832 g/cm³
• LogP: 6.83690
• XLogP3: 8.4
• Hydrogen Bond Donor Count: 0
• Hydrogen Bond Acceptor Count: 1
• Rotatable Bond Count: 16
• Exact Mass: 282.292265831
• Heavy Atom Count: 20
• Complexity: 198

Purity/Quality:

99% ^*data from raw suppliers

2-Nonadecanone ^*data from reagent suppliers

Safty Information:

• Safety Statements: 22-24/25

MSDS Files:

SDS file from LookChem

Total 1 MSDS from other Authors

Useful:

• Canonical SMILES: CCCCCCCCCCCCCCCCCC(=O)C

Technology Process of 2-Nonadecanone

There total 42 articles about 2-Nonadecanone 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: 97.0%

methylmagnesium bromide (75-16-1) + octadecanoic acid tert-butoxy-methyl-amide (778628-28-7) → nonadecan-2-one (629-66-3)

Guidance literature:

In tetrahydrofuran; at 0 ℃; for 1h;

DOI:10.1016/j.tetlet.2004.07.106

Reference yield: 96.0%

2-Heptadecyl-2-methyl-[1,3]dithiane (83622-34-8) → 1,2,6,7-tetrathiacyclodecane (6573-59-7) + nonadecan-2-one (629-66-3)

Guidance literature:

With boron trifluoride diethyl etherate; lead dioxide; In tetrahydrofuran; water; for 1h; Yields of byproduct given; Ambient temperature;

DOI:10.1055/s-1982-29866

Reference yield: 94.0%

methylmagnesium bromide (75-16-1) + N-methoxy-N-methyloctadecanoylamide (80783-97-7) → nonadecan-2-one (629-66-3)

Guidance literature:

In tetrahydrofuran; at 0 ℃; for 0.0166667h;

DOI:10.1016/S0040-4039(01)91316-4

upstream raw materials:

(Z)-10-nonadecen-2-one

Agaric acid

(2S,3S)-2-hydroxy-nonadecane-1,2,3-tricarboxylic acid

1-iodohexadecane

Downstream raw materials:

1-tetradecene

(1R,2R)-1-Methyl-2-tetradecyl-cyclobutanol

(1R,2S)-1-Methyl-2-tetradecyl-cyclobutanol

acetone

Refernces

• 1、 Li, Wenjing,Gao, Yongjun,Yao, Siyu,Ma, Ding,Yan, Ning. "Effective deoxygenation of fatty acids over Ni(OAc)2 in the absence of H2 and solvent". . p. 4198 - 4205. Retrieved 2015/08/11.
• 2、 Wang, Pengfei,Hu, Ayou,Wang, Yun. "Application of the excited state meta effect in photolabile protecting group design". . p. 2831 - 2833. Retrieved 2008/02/07.