3-Methyl-4-phenylbutyraldehyde

Base Information

Chemical Name:3-Methyl-4-phenylbutyraldehyde
CAS No.:13881-14-6
Molecular Formula:C11H14 O
Molecular Weight:162.232
Hs Code.:2912299000
European Community (EC) Number:237-647-5
UNII:T30W53T452
DSSTox Substance ID:DTXSID50930222
Nikkaji Number:J280.357G
Wikidata:Q27289600
Mol file:13881-14-6.mol

Synonyms:3-Methyl-4-phenylbutyraldehyde;13881-14-6;EINECS 237-647-5;UNII-T30W53T452;T30W53T452;3-methyl-4-phenylbutanal;beta-Methylbenzenebutanal;SCHEMBL7354997;3-methyl-4-phenyl-butyraldehyde;DTXSID50930222;.BETA.-METHYLBENZENEBUTANAL;BENZENEBUTANAL, .BETA.-METHYL-;BUTYRALDEHYDE, 3-METHYL-4-PHENYL-;Q27289600

Suppliers and Price of 3-Methyl-4-phenylbutyraldehyde

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 4 raw suppliers

Chemical Property of 3-Methyl-4-phenylbutyraldehyde

Chemical Property:

Vapor Pressure:0.0175mmHg at 25°C
Boiling Point:254.2°Cat760mmHg
Flash Point:118.8°C
PSA：17.07000
Density:0.957g/cm³
LogP:2.45420
XLogP3:2.4
Hydrogen Bond Donor Count:0
Hydrogen Bond Acceptor Count:1
Rotatable Bond Count:4
Exact Mass:162.104465066
Heavy Atom Count:12
Complexity:125

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

Safty Information:

Pictogram(s):
Hazard Codes:

MSDS Files:: SDS file from LookChem

Useful:

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

Technology Process of 3-Methyl-4-phenylbutyraldehyde

There total 11 articles about 3-Methyl-4-phenylbutyraldehyde 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: 80.0%

: 83126-02-7
(E)-3-methyl-4-phenylbut-3-ene-1-ol

: 13881-14-6
3-methyl-4-phenylbutanal

Guidance literature:: With cis-chloromethyl[bis(dicyclohexylphosphino)ethane]palladium(II); sodium tetrakis[(3,5-di-trifluoromethyl)phenyl]borate; In 1,2-dichloro-ethane; cyclohexene; at 20 - 85 ℃; for 18h; Inert atmosphere; Sealed tube;
DOI:10.1021/ja508736u

Reference yield: 69.0%

: 763-32-6
2-methyl-1-buten-4-ol

: 591-50-4
iodobenzene

: 13881-14-6
3-methyl-4-phenylbutanal

Guidance literature:: With lithium acetate; tetrabutyl-ammonium chloride; lithium chloride; palladium diacetate; In N,N-dimethyl-formamide; at 50 ℃; for 84h;
DOI:10.1016/S0040-4039(00)70636-8

Reference yield: 63.0%

: 766-90-5
cis-1-phenyl-1-propylene

: 109-92-2,25104-37-4
ethyl vinyl ether

: 13881-14-6
3-methyl-4-phenylbutanal

Guidance literature:: With 10-phenyl-9-(2,4,6-trimethylphenyl)acridinium tetrafluoroborate; diphenyldisulfane; In 1,2-dichloro-ethane; chemoselective reaction; Inert atmosphere; Irradiation;
DOI:10.1002/anie.201712384