2-Propylhexanal

Base Information

Chemical Name:2-Propylhexanal
CAS No.:27644-47-9
Molecular Formula:C₉H₁₈O
Molecular Weight:142.241
Hs Code.:
DSSTox Substance ID:DTXSID60452445
Nikkaji Number:J875.052A
Mol file:27644-47-9.mol

Synonyms:2-propylhexanal;Hexanal, 2-propyl-;2-propyl hexanal;27644-47-9;SCHEMBL1410522;DTXSID60452445;IREORVYCKDQFMD-UHFFFAOYSA-N;AKOS006324978

Suppliers and Price of 2-Propylhexanal

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

Total 0 raw suppliers

Chemical Property of 2-Propylhexanal

Chemical Property:

PSA：17.07000
LogP:2.79180
XLogP3:3.1
Hydrogen Bond Donor Count:0
Hydrogen Bond Acceptor Count:1
Rotatable Bond Count:6
Exact Mass:142.135765193
Heavy Atom Count:10
Complexity:78.8

Purity/Quality:

Safty Information:

Pictogram(s):
Hazard Codes:

MSDS Files:: SDS file from LookChem

Useful:

Canonical SMILES:CCCCC(CCC)C=O

Technology Process of 2-Propylhexanal

There total 26 articles about 2-Propylhexanal 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: 66.5%

: 14919-01-8
(E)-3-octene

: 201230-82-2
carbon monoxide

: 27649-40-7
2-ethylheptanal

: 49642-49-1,55352-42-6,72598-55-1,7786-29-0
2-methyl-1-octanal

: 140238-46-6,140238-47-7,27644-47-9
2-n-propylhexanal

Guidance literature:: With zinc 5,10,15,20-tetraphenylporphyrin; N-ethyl-N,N-diisopropylamine; tri(pyridin-3-yl)phosphine; acetylacetonatodicarbonylrhodium(l); In toluene; at 40 ℃; for 42h;
DOI:10.1021/ja063294i

Reference yield: 43.0%

: 111-67-1
2-octene

: 201230-82-2
carbon monoxide

: 124-19-6
nonan-1-al

: 27649-40-7
2-ethylheptanal

: 49642-49-1,55352-42-6,72598-55-1,7786-29-0
2-methyl-1-octanal

: 140238-46-6,140238-47-7,27644-47-9
2-n-propylhexanal

Guidance literature:: With acetylacetonatodicarbonylrhodium(l); hydrogen; bis-2,6-(2,4-dimethylphenyl)-4-phenylphosphabenzene; In toluene; at 90 ℃; for 4h; under 7500.6 Torr; Further Variations:; Catalysts; Product distribution;
DOI:10.1002/1521-3765(20010716)7:14<3106::AID-CHEM3106>3.0.CO;2-Y

Reference yield: 0.7%

: 13389-42-9
trans-2-Octene

: 201230-82-2
carbon monoxide

: 124-19-6
nonan-1-al

: 27649-40-7
2-ethylheptanal

: 49642-49-1,55352-42-6,72598-55-1,7786-29-0
2-methyl-1-octanal

: 140238-46-6,140238-47-7,27644-47-9
2-n-propylhexanal

Guidance literature:: With zinc 5,10,15,20-tetraphenylporphyrin; N-ethyl-N,N-diisopropylamine; tri(pyridin-3-yl)phosphine; acetylacetonatodicarbonylrhodium(l); In toluene; at 25 ℃; for 73h; Further Variations:; Catalysts; Temperatures; Product distribution;
DOI:10.1021/ja063294i