3-(4-Ethylphenyl)-2,2-dimethylpropanal

Base Information

Chemical Name:3-(4-Ethylphenyl)-2,2-dimethylpropanal
CAS No.:67634-15-5
Molecular Formula:C₁₃H₁₈O
Molecular Weight:190.285
Hs Code.:2912299000
European Community (EC) Number:266-819-2
UNII:5V2FN5AA3W
DSSTox Substance ID:DTXSID3052359
Nikkaji Number:J333.250K
Wikidata:Q27262908
RXCUI:1649018
Mol file:67634-15-5.mol

Synonyms:3-(4-ethylphenyl)-2,2-dimethylpropanal;floralozone

Suppliers and Price of 3-(4-Ethylphenyl)-2,2-dimethylpropanal

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

TRC
3-(4-Ethylphenyl)-2,2-dimethylpropanal
100g
$ 450.00

TRC
3-(4-Ethylphenyl)-2,2-dimethylpropanal
25g
$ 150.00

Crysdot
3-(4-Ethylphenyl)-2,2-dimethylpropanal 95+%
1g
$ 564.00

American Custom Chemicals Corporation
3-(4-ETHYLPHENYL)-2,2-DIMETHYLPROPANAL 95.00%
5MG
$ 497.75

Alichem
3-(4-Ethylphenyl)-2,2-dimethylpropanal
1g
$ 501.40

Total 46 raw suppliers

Chemical Property of 3-(4-Ethylphenyl)-2,2-dimethylpropanal

Chemical Property:

Vapor Pressure:0.00808mmHg at 25°C
Refractive Index:1.5310 (estimate)
Boiling Point:267.6°Cat760mmHg
Flash Point:118°C
PSA：17.07000
Density:0.952
LogP:3.01660
Storage Temp.:2-8°C
Solubility.:Chloroform (Sparingly), Ethyl Acetate (Slightly), Hexanes (Sparingly)
XLogP3:3.3
Hydrogen Bond Donor Count:0
Hydrogen Bond Acceptor Count:1
Rotatable Bond Count:4
Exact Mass:190.135765193
Heavy Atom Count:14
Complexity:176

Purity/Quality:

99% ^*data from raw suppliers

3-(4-Ethylphenyl)-2,2-dimethylpropanal ^*data from reagent suppliers

Safty Information:

Pictogram(s):
Hazard Codes:

MSDS Files:: SDS file from LookChem

Useful:

Canonical SMILES:CCC1=CC=C(C=C1)CC(C)(C)C=O
Uses 3-(4-Ethylphenyl)-2,2-dimethylpropanal is an odorant used in antiperspirants.

Technology Process of 3-(4-Ethylphenyl)-2,2-dimethylpropanal

There total 3 articles about 3-(4-Ethylphenyl)-2,2-dimethylpropanal 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: 82.8%

: 57825-30-6
4-ethylbenzyl bromide

: 78-84-2
isobutyraldehyde

: 67634-15-5
4-ethyl-α,α-dimethyl-benzenepropanal

Guidance literature:: With sodium hydroxide; (4-ethyl-benzyl)-trimethyl-ammonium; bromide; In tetrahydrofuran; water; toluene; at 70 - 75 ℃; for 3h; Product distribution / selectivity;

Reference yield:

: 50-00-0,30525-89-4,61233-19-0
formaldehyd

: 100-41-4,27536-89-6
ethylbenzene

: 78-84-2
isobutyraldehyde

: 67634-15-5
4-ethyl-α,α-dimethyl-benzenepropanal

: 67634-14-4
2-ethyl-2,2-dimethyl-3-phenylpropanal

Guidance literature:: formaldehyd; ethylbenzene; With hydrogenchloride; sulfuric acid; tetrabutylammomium bromide; In water; at 50 ℃; for 20h;

isobutyraldehyde; With tetrabutyl-ammonium chloride; sodium hydroxide; In ethylbenzene; water; at 80 - 130 ℃; for 15h; Reagent/catalyst; Temperature;

Reference yield:

: 50-00-0,30525-89-4,61233-19-0
formaldehyd

: 100-41-4,27536-89-6
ethylbenzene

: 78-84-2
isobutyraldehyde

: 67634-15-5
4-ethyl-α,α-dimethyl-benzenepropanal

: 67634-14-4
2-ethyl-2,2-dimethyl-3-phenylpropanal

: 3-ethyl-2,2-dimethyl-3-phenylpropanal

Guidance literature:: formaldehyd; ethylbenzene; With hydrogenchloride; sulfuric acid; tetrabutyl-ammonium chloride; In water; at 65 ℃; for 15h;

isobutyraldehyde; With tetrabutyl-ammonium chloride; sodium hydroxide; In water; at 72 ℃; for 9h; Reagent/catalyst; Temperature; Overall yield = 85 %;