3-Benzyl-2-methylbutyraldehyde

Base Information

Chemical Name:3-Benzyl-2-methylbutyraldehyde
CAS No.:83498-25-3
Molecular Formula:C12H16O
Molecular Weight:176.258
Hs Code.:
European Community (EC) Number:280-468-2
DSSTox Substance ID:DTXSID201003483
Nikkaji Number:J326.812H

Synonyms:3-Benzyl-2-methylbutyraldehyde;83498-25-3;EINECS 280-468-2;2,3-dimethyl-4-phenylbutanal;alpha,beta-Dimethylbenzenebutanal;DTXSID201003483

Suppliers and Price of 3-Benzyl-2-methylbutyraldehyde

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 7 raw suppliers

Chemical Property of 3-Benzyl-2-methylbutyraldehyde

Chemical Property:

Vapor Pressure:0.00901mmHg at 25°C
Boiling Point:265.7°C at 760 mmHg
Flash Point:122.5°C
PSA：17.07000
Density:0.945g/cm³
LogP:2.70020
XLogP3:3
Hydrogen Bond Donor Count:0
Hydrogen Bond Acceptor Count:1
Rotatable Bond Count:4
Exact Mass:176.120115130
Heavy Atom Count:13
Complexity:147

Purity/Quality:: 99% ^*data from raw suppliers

Safty Information:

Pictogram(s):
Hazard Codes:

MSDS Files:

Useful:

Canonical SMILES:CC(CC1=CC=CC=C1)C(C)C=O

Technology Process of 3-Benzyl-2-methylbutyraldehyde

There total 2 articles about 3-Benzyl-2-methylbutyraldehyde 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: 70.0%

: 21869-55-6,29393-17-7,94942-91-3,2550-27-8
3-methyl-4-phenylbutan-2-one

: 4009-98-7
(methoxymethyl)triphenylphosphonium chloride

: 83498-25-3
C₁₂H₁₆O

Guidance literature:: (methoxymethyl)triphenylphosphonium chloride; With n-butyllithium; In tetrahydrofuran; hexane; at 0 ℃; for 1h; Inert atmosphere;

3-methyl-4-phenylbutan-2-one; In tetrahydrofuran; hexane; at 0 - 20 ℃; Inert atmosphere;

With hydrogenchloride; In tetrahydrofuran; water; at 90 ℃; for 2h; Inert atmosphere;
DOI:10.1021/ja406028c

Reference yield:

: 83498-25-3
C₁₂H₁₆O

: 57919-02-5
4-methyl-5-phenylpentanal

Guidance literature:: With chloro(1,5-cyclooctadiene)rhodium(I) dimer; hydrogen; triphenylphosphine; In N,N-dimethyl-formamide; at 100 ℃; for 12h; under 22502.3 Torr; Overall yield = 68 percentChromat.; Autoclave;

Reference yield: 75.0%

: 83498-25-3
C₁₂H₁₆O

: 56836-93-2
3-methyl-4-phenylbutan-2-ol

Guidance literature:: C₁₂H₁₆O; With Co(3-Me-5-MeO-salen); In acetonitrile; at -20 - 20 ℃; for 0.166667h; Inert atmosphere;

With dihydrogen peroxide; In water; acetonitrile; at -20 ℃; for 24h; Further stages; Inert atmosphere;
DOI:10.1021/ja406028c