4-(Diethylamino)benzaldehyde

Base Information

Chemical Name:4-(Diethylamino)benzaldehyde
CAS No.:120-21-8
Molecular Formula:C11H15NO
Molecular Weight:177.246
Hs Code.:29223990
European Community (EC) Number:204-377-4
NSC Number:8782
UNII:S640XWL10H
DSSTox Substance ID:DTXSID0021963
Nikkaji Number:J37.725B
Wikidata:Q27158973
Pharos Ligand ID:GTR5D6ASUXUF
ChEMBL ID:CHEMBL3416563
Mol file:120-21-8.mol

Synonyms:4-(diethylamino)benzaldehyde;DEABZ

Suppliers and Price of 4-(Diethylamino)benzaldehyde

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

TCI Chemical
4-Diethylaminobenzaldehyde >99.0%(GC)(T)
500g
$ 223.00

TCI Chemical
4-Diethylaminobenzaldehyde >99.0%(GC)(T)
100g
$ 45.00

TCI Chemical
4-Diethylaminobenzaldehyde >99.0%(GC)(T)
25g
$ 20.00

SynQuest Laboratories
4-(Diethylamino)benzaldehyde
5 g
$ 23.00

Sigma-Aldrich
4-Diethylaminobenzaldehyde 99%
100g
$ 50.50

Matrix Scientific
4-(Diethylamino)benzaldehyde 95%+
5g
$ 323.00

Matrix Scientific
4-(Diethylamino)benzaldehyde 95%+
2.500g
$ 215.00

Matrix Scientific
4-(Diethylamino)benzaldehyde 95%+
1g
$ 101.00

Frontier Specialty Chemicals
4-Diethylaminobenzaldehyde 99%
25g
$ 16.00

Frontier Specialty Chemicals
4-Diethylaminobenzaldehyde 99%
100g
$ 51.00

Total 111 raw suppliers

Chemical Property of 4-(Diethylamino)benzaldehyde

Chemical Property:

Appearance/Colour:dark brown to green coarse crystals
Vapor Pressure:0.000176mmHg at 25°C
Melting Point:37-41 °C(lit.)
Refractive Index:1.571
Boiling Point:329.6 °C at 760 mmHg
PKA:3.36±0.32(Predicted)
Flash Point:110.2 °C
PSA：20.31000
Density:1.029 g/cm³
LogP:2.34530
Storage Temp.:Store below +30°C.
Sensitive.:Air Sensitive
Solubility.:2.5g/l
Water Solubility.:insoluble
XLogP3:2.5
Hydrogen Bond Donor Count:0
Hydrogen Bond Acceptor Count:2
Rotatable Bond Count:4
Exact Mass:177.115364102
Heavy Atom Count:13
Complexity:146

Purity/Quality:

99% ^*data from raw suppliers

4-Diethylaminobenzaldehyde >99.0%(GC)(T) ^*data from reagent suppliers

Safty Information:

Pictogram(s): Xi,Xn
Hazard Codes:Xi,N,Xn
Statements: 36/37/38-50/53-21/22
Safety Statements: 26-36-61-60-36/37

MSDS Files:: SDS file from LookChem

Useful:

Canonical SMILES:CCN(CC)C1=CC=C(C=C1)C=O
Description 4-(Diethylamino)benzaldehyde belongs to the class of benzaldehydes and carries a diethylamino substituent at position 4. It is categorized as a tertiary amino compound and an aromatic amine.
Uses 4-(Diethylamino)benzaldehyde is known as a pan-inhibitor of ALDH isoforms, especially ALDH1A1, ALDH1A3, and ALDH3A1. Used in cancer research to identify cancer stem cell populations and explore therapeutic interventions targeting ALDH.^[1]
Production Methods Synthesized through chemical reactions between 4-(diethylamino)benzaldehyde and quinolinemalononitrile in a solvent mixture of absolute ethanol and piperidine.^[2]
References [1] Expansion of the 4-(Diethylamino)benzaldehyde Scaffold to Explore the Impact on Aldehyde Dehydrogenase Activity and Antiproliferative Activity in Prostate Cancer
DOI 10.1021/acs.jmedchem.1c01367
[2] Crystal structure of (E)-2-(2-(4-(diethylamino)styryl)-1-ethyl-1,4-dihydroquinolin-4-yl) malononitrile, C26H26N4
DOI 10.1515/ncrs-2023-0340

Technology Process of 4-(Diethylamino)benzaldehyde

There total 21 articles about 4-(Diethylamino)benzaldehyde 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: 92.1%