Details
Stereochemistry | ACHIRAL |
Molecular Formula | C4H11NO2 |
Molecular Weight | 105.1356 |
Optical Activity | NONE |
Defined Stereocenters | 0 / 0 |
E/Z Centers | 0 |
Charge | 0 |
SHOW SMILES / InChI
SMILES
OCCNCCO
InChI
InChIKey=ZBCBWPMODOFKDW-UHFFFAOYSA-N
InChI=1S/C4H11NO2/c6-3-1-5-2-4-7/h5-7H,1-4H2
Molecular Formula | C4H11NO2 |
Molecular Weight | 105.1356 |
Charge | 0 |
Count |
|
Stereochemistry | ACHIRAL |
Additional Stereochemistry | No |
Defined Stereocenters | 0 / 0 |
E/Z Centers | 0 |
Optical Activity | NONE |
Diethanolamine (DEA) is an amino alcohol commonly used in the preparation of soaps and surfactants, agricultural chemicals and in textile processing. DEA and DEA-Derivatives are used in other products besides cosmetics and personal care products. For example, DEA and DEA-derivatives have been approved for several food-related applications, primarily food packaging.
Approval Year
Targets
Primary Target | Pharmacology | Condition | Potency |
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Target ID: GO:0015871 Sources: https://www.ncbi.nlm.nih.gov/pubmed/17204582 |
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Target ID: GO:0019695 Sources: https://www.ncbi.nlm.nih.gov/pubmed/17204582 |
Conditions
Condition | Modality | Targets | Highest Phase | Product |
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Curative | GANTRISIN Approved UseAntibacterial Launch Date1953 |
PubMed
Title | Date | PubMed |
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NTP Toxicology and Carcinogenesis Studies of Diethanolamine (CAS No. 111-42-2) in F344/N Rats and B6C3F1 Mice (Dermal Studies). | 1999 Jul |
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Toxicology and carcinogenesis studies of coconut oil acid diethanolamine condensate (CAS No. 68603-42-9) in F344/N rats and B6C3F1 mice (dermal studies). | 2001 Jan |
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Tritosylate of diethanolamine. | 2001 Mar |
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Evaluation of the impurity profile of alcuronium by means of capillary electrophoresis. | 2002 Jun 1 |
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The unusually high proton affinity of aza-18-crown-6 ether: implications for the molecular recognition of lysine in peptides by lariat crown ethers. | 2002 May |
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Low-volume jet injection for intradermal immunization in rabbits. | 2002 May 23 |
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The effect of different buffers and amounts of intestinal alkaline phosphatase isoforms on total alkaline phosphatase activity. | 2002 May 7 |
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Local anaesthetic effects and toxicity of seven new diethanolamine and morpholine derivatives of fomocaine. Testing in rats compared with procaine and tetracaine. | 2003 |
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Percentage of the positive area of bone metastasis is an independent predictor of disease death in advanced prostate cancer. | 2003 Jan 27 |
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A new stressed test to predict the foreign matter formation of minodronic acid in solution. | 2003 Jan 30 |
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[Separation of carbon dioxide from gas mixture by membrane contactor]. | 2003 Sep |
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An adapted ELISA method for differentiating pathogenic from nonpathogenic aPL by a beta 2 glycoprotein I dependency anticardiolipin assay. | 2004 |
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Determination of alkanolamines in cattails (Typha latifolia) utilizing electrospray ionization with selected reaction monitoring and ion-exchange chromatography. | 2004 |
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Development of a fully buffered molybdate electrolyte for capillary electrophoresis with indirect detection and its use for analysis of anions in Bayer liquor. | 2004 Feb |
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Physicochemical and crystallographic characterization of mefenamic acid complexes with alkanolamines. | 2004 Jan |
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Theoretical scales of hydrogen bond acidity and basicity for application in QSAR/QSPR studies and drug design. Partitioning of aliphatic compounds. | 2004 May-Jun |
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Assembling novel heterotrimetallic Cu/Co/Ni and Cu/Co/Cd cores supported by diethanolamine ligand in one-pot reactions of zerovalent copper with metal salts. | 2004 Nov 29 |
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In vitro human skin penetration of diethanolamine. | 2004 Oct |
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Patch test results with the metalworking fluid series of the German Contact Dermatitis Research Group (DKG). | 2004 Sep |
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Brainstem levels of transcription factor AP-2 in rat are changed after treatment with phenelzine, but not with citalopram. | 2005 Jan 21 |
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Prediction of genotoxicity of chemical compounds by statistical learning methods. | 2005 Jun |
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Simultaneous detection of monoethanolamine, diethanolamine, and triethanolamine by HPLC with a chemiluminescence reaction and online derivatization to tertiary amine. | 2005 May |
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Small-angle neutron scattering of ionic perfluoropolyether micellar solutions: role of counterions and temperature. | 2005 May 12 |
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Species differences in the induction of hepatocellular DNA synthesis by diethanolamine. | 2005 Oct |
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Investigation of the formation of N-nitrosodiethanolamine in B6C3F1 mice following topical administration of triethanolamine. | 2005 Oct |
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Stimulating effect of Japanese herbal (kampo) medicine, hochuekkito on upper respiratory mucosal immune system. | 2006 Dec |
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Cloning, functional expression and primary characterization of Vibrio parahaemolyticus K+/H+ antiporter genes in Escherichia coli. | 2006 Jan |
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Potassium/proton antiport system of Escherichia coli. | 2006 Jul 21 |
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Chemical exposures. Will DEA findings wash? | 2006 Nov |
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Diethanolamine alters proliferation and choline metabolism in mouse neural precursor cells. | 2007 Apr |
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hnRNP E1 and E2 have distinct roles in modulating HIV-1 gene expression. | 2007 Apr 23 |
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Regenerating fuel-gas desulfurizing agents by using bipolar membrane electrodialysis (BMED): effect of molecular structure of alkanolamines on the regeneration performance. | 2007 Feb 1 |
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CO2 absorption in aqueous solutions of alkanolamines: mechanistic insight from quantum chemical calculations. | 2007 Feb 22 |
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DEA in consumer products is safe. | 2007 Jan |
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Cholesterol synthesis inhibitors protect against platelet-activating factor-induced neuronal damage. | 2007 Jan 18 |
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Determination of occupational exposure to alkanolamines in metal-working fluids. | 2007 Mar |
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Biodegradation of novel amino acid derivatives suitable for complexing agents in pulp bleaching applications. | 2007 May 1 |
Patents
Sample Use Guides
In Vivo Use Guide
Sources: https://www.ncbi.nlm.nih.gov/pubmed/12571685
MICE: Groups of 50 male and 50 female mice were administered 0, 40, 80, or 160 mg diethanolamine/kg body weight in ethanol dermally for 2 years. In male mice, the incidences of hepatocellular adenoma and of hepatocellular adenoma or carcinoma (combined) in all dosed groups and of hepatocellular carcinoma and hepatoblastoma in 80 and 160 mg/kg males were significantly increased compared to the vehicle controls.
Route of Administration:
Other
Sperm suspension was incubated with different concentrations (100–500 ug/mL) of diethanolamine to evaluate sperm parameters such as sperm motility, sperm viability and sperm morphology. diethanolamine caused significant decrease in sperm motility and sperm viability which was concentration and time–dependent.
Substance Class |
Chemical
Created
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admin
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Edited
Sat Dec 16 17:01:42 GMT 2023
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Record UNII |
AZE05TDV2V
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Record Status |
Validated (UNII)
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CFR |
21 CFR 176.170
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C020283
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DIETHANOLAMINE
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