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Small Molecules & Compound Libraries
Signaling Pathways
Metabolic Enzyme/Protease
Aldehyde Dehydrogenase (ALDH)
4-Diethylaminobenzaldehyde - 98%, high purity , CAS No.120-21-8

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4-Diethylaminobenzaldehyde - 98%, high purity , CAS No.120-21-8

13 Citations

COA

Grade & Purity:

≥98%

Cas Number: 120-21-8
Molecular Weight: 177.24
Beilstein Registry Number: 511102
EC Number: MFCD00003382
MDL number: MFCD00003382
PubChem CID: 67114
PubChem SID: 504754118

In stock

Item Number

D104213

Grouped product items
SKU	Size	Availability	Price
D104213-25g	25g	3	$19.90
D104213-100g	100g	3	$42.90
D104213-500g	500g	2	$192.90

View related series

aldehyde (388) Aldehyde Dehydrogenase (ALDH) (31) Lipid metabolism (1912) Metabolic Enzyme/Protease (4860) Non heterocyclic block (8163)

Basic Description

Synonyms	Benzaldehyde, p-(diethylamino)- \| DIETHYLAMINOBENZALDEHYDE, P- \| 4-(Diethylamino)benzaldehyde \| 4-(Diethylamino)-Benzaldehyde \| 4-N,N-Diethylamino benzaldehyde \| InChI=1/C11H15NO/c1-3-12(4-2)11-7-5-10(9-13)6-8-11/h5-9H,3-4H2,1-2H \| AKOS000118909 \| p-N,N-d
Specifications & Purity	≥98%
Storage Temp	Store at 2-8°C,Argon charged
Shipped In	Wet ice This product requires cold chain shipping. Ground and other economy services are not available.

Taxonomic Classification

Taxonomy Tree

Kingdom Organic compounds
- Superclass Benzenoids
  - Class Benzene and substituted derivatives
    - Subclass Benzoyl derivatives

Kingdom	Organic compounds
Superclass	Benzenoids
Class	Benzene and substituted derivatives
Subclass	Benzoyl derivatives
Intermediate Tree Nodes	Not available
Direct Parent	Benzoyl derivatives
Alternative Parents	Dialkylarylamines Benzaldehydes Aniline and substituted anilines Organopnictogen compounds Organic oxides Hydrocarbon derivatives
Molecular Framework	Aromatic homomonocyclic compounds
Substituents	Benzaldehyde - Benzoyl - Tertiary aliphatic/aromatic amine - Dialkylarylamine - Aniline or substituted anilines - Aryl-aldehyde - Tertiary amine - Organic oxide - Aldehyde - Organopnictogen compound - Organooxygen compound - Organonitrogen compound - Organic oxygen compound - Organic nitrogen compound - Amine - Hydrocarbon derivative - Aromatic homomonocyclic compound
Description	This compound belongs to the class of organic compounds known as benzoyl derivatives. These are organic compounds containing an acyl moiety of benzoic acid with the formula (C6H5CO-).
External Descriptors	tertiary amino compound - aromatic amine - benzaldehydes
1. Djoumbou Feunang Y, Eisner R, Knox C, Chepelev L, Hastings J, Owen G, Fahy E, Steinbeck C, Subramanian S, Bolton E, Greiner R, and Wishart DS. ClassyFire: Automated Chemical Classification With A Comprehensive, Computable Taxonomy. Journal of Cheminformatics, 2016, 8:61. DOI: 10.1186/s13321-016-0174-y

Associated Targets(Human)

ALDH1A1 Tchem Retinal dehydrogenase 1 (3 Activities)

Discover Target: ALDH1A1

Activity Type	Activity Value -log(M)	Mechanism of Action	Activity Reference	Publications (PubMed IDs)

ALDH2 Tclin Aldehyde dehydrogenase (509 Activities)

Discover Target: ALDH2

Activity Type	Relation	Activity value	Units	Action Type	Journal	PubMed Id	doi	Assay Aladdin ID

ALDH1A1 Tchem Aldehyde dehydrogenase 1A1 (77053 Activities)

Discover Target: ALDH1A1

Activity Type	Relation	Activity value	Units	Action Type	Journal	PubMed Id	doi	Assay Aladdin ID

ALDH3A1 Tchem Aldehyde dehydrogenase dimeric NADP-preferring (307 Activities)

Discover Target: ALDH3A1

Activity Type	Relation	Activity value	Units	Action Type	Journal	PubMed Id	doi	Assay Aladdin ID

ALDH1A3 Tchem Aldehyde dehydrogenase 1A3 (336 Activities)

Discover Target: ALDH1A3

Activity Type	Relation	Activity value	Units	Action Type	Journal	PubMed Id	doi	Assay Aladdin ID

DU-145 (51482 Activities)

Explore this target

Activity Type	Relation	Activity value	Units	Action Type	Journal	PubMed Id	doi	Assay Aladdin ID

PC-3 (62116 Activities)

Explore this target

Activity Type	Relation	Activity value	Units	Action Type	Journal	PubMed Id	doi	Assay Aladdin ID

Mechanisms of Action

Mechanism of Action	Action Type	target ID	Target Name	Target Type	Target Organism	Binding Site Name	References

Names and Identifiers

Pubchem Sid	504754118
Pubchem Sid Url	https://pubchem.ncbi.nlm.nih.gov/substance/504754118
IUPAC Name	4-(diethylamino)benzaldehyde
INCHI	InChI=1S/C11H15NO/c1-3-12(4-2)11-7-5-10(9-13)6-8-11/h5-9H,3-4H2,1-2H3
InChIKey	MNFZZNNFORDXSV-UHFFFAOYSA-N
Smiles	CCN(CC)C1=CC=C(C=C1)C=O
Isomeric SMILES	CCN(CC)C1=CC=C(C=C1)C=O
WGK Germany	2
RTECS	CU5612850
UN Number	3077
Molecular Weight	177.24
Beilstein	511102
Reaxy-Rn	511102
Reaxys-RN_link_address	https://www.reaxys.com/reaxys/secured/hopinto.do?context=S&query=IDE.XRN=511102&ln=

Certificates（CoA,COO,BSE/TSE and Analysis Chart)

C of A & Other Certificates(BSE/TSE, COO):

Analytical Chart:

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5 results found

Lot Number	Certificate Type	Date	Item
G2416248	Certificate of Analysis	May 06, 2024	D104213
F2208271	Certificate of Analysis	Mar 20, 2024	D104213
F2208270	Certificate of Analysis	Mar 20, 2024	D104213
I2007250	Certificate of Analysis	Jul 08, 2022	D104213
I2007249	Certificate of Analysis	Jul 08, 2022	D104213

Chemical and Physical Properties

Solubility	Insoluble in water.
Sensitivity	air sensitive
Flash Point(°F)	235.4 °F
Flash Point(°C)	>110℃
Boil Point(°C)	174°C
Melt Point(°C)	41°C
Molecular Weight	177.240 g/mol
XLogP3	2.500
Hydrogen Bond Donor Count	0
Hydrogen Bond Acceptor Count	2
Rotatable Bond Count	4
Exact Mass	177.115 Da
Monoisotopic Mass	177.115 Da
Topological Polar Surface Area	20.300 Å²
Heavy Atom Count	13
Formal Charge	0
Complexity	146.000
Isotope Atom Count	0
Defined Atom Stereocenter Count	0
Undefined Atom Stereocenter Count	0
Defined Bond Stereocenter Count	0
Undefined Bond Stereocenter Count	0
The total count of all stereochemical bonds	0
Covalently-Bonded Unit Count	1

Citations of This Product

How to Cite Aladdin Scientific Products? Citations Search

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