(S)-2-Methylhexanal

Base Information

Chemical Name:(S)-2-Methylhexanal
CAS No.:66875-71-6
Molecular Formula:C7H14O
Molecular Weight:114.188
Hs Code.:
UNII:4W2UHT6RBE
Nikkaji Number:J2.436.013J

Synonyms:(2S)-2-methylhexanal;(S)-2-Methylhexanal;(+)-2-Methylhexanal;Hexanal, 2-methyl-, (2S)-;2-Methylhexanal, (S)-;4W2UHT6RBE;2-Methylhexanal, (+)-;(s)-2-methyl-1-hexanal;66875-71-6;UNII-4W2UHT6RBE;SCHEMBL3485194;EN300-6490183

Suppliers and Price of (S)-2-Methylhexanal

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
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price

Total 0 raw suppliers

Chemical Property of (S)-2-Methylhexanal

Chemical Property:

XLogP3:2.2
Hydrogen Bond Donor Count:0
Hydrogen Bond Acceptor Count:1
Rotatable Bond Count:4
Exact Mass:114.104465066
Heavy Atom Count:8
Complexity:59.4

Purity/Quality:

Safty Information:

Pictogram(s):
Hazard Codes:

MSDS Files:: SDS file from LookChem

Useful:

Canonical SMILES:CCCCC(C)C=O
Isomeric SMILES:CCCC[C@H](C)C=O

Technology Process of (S)-2-Methylhexanal

There total 3 articles about (S)-2-Methylhexanal 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: 76.0%

: 592-41-6,25067-06-5
1-hexene

: 201230-82-2
carbon monoxide

: 111-71-7
heptanal

: 132151-88-3
R-(-)-2-methylhexanal

: 66875-71-6
S-(+)-2-methylhexanal

Guidance literature:: With acetylacetonatodicarbonylrhodium(l); hydrogen; (R,S)-binaphos; In benzene; under 76000 Torr; Yield given. Yields of byproduct given. Title compound not separated from byproducts;
DOI:10.1021/ja970049d

Reference yield:

: 592-41-6,25067-06-5
1-hexene

: 201230-82-2
carbon monoxide

: 111-71-7
heptanal

: 66875-71-6
S-(+)-2-methylhexanal

Guidance literature:: With hydrogen; acetylacetonatodicarbonylrhodium(l); (S,S,S)-BOBPHOS; In toluene; at 20 ℃; for 46h; under 3750.38 Torr; Product distribution / selectivity; Inert atmosphere; Autoclave;

Reference yield:

: 592-41-6,25067-06-5
1-hexene

: 19710-56-6,63541-95-7,81434-73-3,86549-47-5,96026-45-8,99663-53-3
hydroxycarbene

: 111-71-7
heptanal

: 66875-71-6
S-(+)-2-methylhexanal

Guidance literature:: With (acetylacetonato)dicarbonylrhodium (l); bobphos (Sax,S,S); hydrogen; In toluene; at 16 ℃; for 46h; under 3750.38 Torr; optical yield given as %ee; enantioselective reaction;
DOI:10.1002/anie.201108203