Ethanolamine

Base Information

• Chemical Name: Ethanolamine
• CAS No.: 85047-08-1
• Deprecated CAS: 9007-33-4,2122854-11-7,2169804-94-6
• Molecular Formula: C2H3 D4 N O
• Molecular Weight: 65.0519
• European Community (EC) Number: 205-483-3,602-036-8,602-038-9,618-436-0,682-672-0,685-828-6,690-571-8
• ICSC Number: 0152
• UN Number: 2491
• UNII: 5KV86114PT
• DSSTox Substance ID: DTXSID6022000
• Nikkaji Number: J2.536D
• Wikipedia: Ethanolamine
• Wikidata: Q410387
• NCI Thesaurus Code: C61756
• RXCUI: 24457
• Metabolomics Workbench ID: 37102
• ChEMBL ID: CHEMBL104943
• Mol file: 85047-08-1.mol

Synonyms:2 Aminoethanol;2-Aminoethanol;Colamine;Ethanolamine;Monoethanolamine

Chemical Property of Ethanolamine

Chemical Property:

• Melting Point: 11 °C(lit.)
• Boiling Point: 170 °C(lit.)
• Flash Point: 93 °C
• PSA: 46.25000
• Density: 1.080 g/mL at 25 °C
• LogP: -0.36230
• XLogP3: -1.3
• Hydrogen Bond Donor Count: 2
• Hydrogen Bond Acceptor Count: 2
• Rotatable Bond Count: 1
• Exact Mass: 61.052763847
• Heavy Atom Count: 4
• Complexity: 10
• Transport DOT Label: Corrosive

Purity/Quality:

99%, ^*data from raw suppliers

2-Aminoethan-1,1,2,2-d4-ol ^*data from reagent suppliers

Safty Information:

• Hazard Codes: Xn,C
• Statements: 20-36/37/38-34-20/21/22
• Safety Statements: 26-36/37/39-45

MSDS Files:

SDS file from LookChem

Useful:

• Chemical Classes: Nitrogen Compounds -> Ethanolamines
• Canonical SMILES: C(CO)N
• Inhalation Risk: A harmful contamination of the air will be reached rather slowly on evaporation of this substance at 20 °C; on spraying or dispersing, however, much faster.
• Effects of Short Term Exposure: The substance is corrosive to the skin and eyes. Corrosive on ingestion. The vapour is irritating to the eyes, skin and respiratory tract. The substance may cause effects on the central nervous system. This may result in lowering of consciousness.

Technology Process of Ethanolamine

There total 2 articles about Ethanolamine 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:

N-(2-hydroxyethyl-1,1,2,2-(2)H4)-5Z,8Z,11Z,14Z-eicosatetraenamide (946524-40-9) → all cis 5,8,11,14-eicosatetraenoic acid (506-32-1,236743-58-1) + 2-amino(2H4)ethan-1-ol (85047-08-1)

Guidance literature:

With recombinant human fatty acid amide hydrolase; at 37 ℃; pH=7.3; Kinetics; aq. phosphate buffer; Enzymatic reaction;

DOI:10.1016/j.ab.2011.11.003

Reference yield:

<2-2H2>glycine (4896-75-7) → 2-amino(2H4)ethan-1-ol (85047-08-1)

Guidance literature:

With lithium aluminium deuteride;

DOI:10.1016/j.bmcl.2009.02.022

Reference yield: 79.0%

C15H15ClN4O2 (1542204-45-4) + 2-amino(2H4)ethan-1-ol (85047-08-1) → 2-((1,2-[2H4]-2-hydroxyethyl)amino)-1-ethyl-7-(4-methoxybenzyl)-1H-purin-6(7H)-one (1542204-48-7)

Guidance literature:

In 1-methyl-pyrrolidin-2-one; at 130 ℃; for 4h; Inert atmosphere;

DOI:10.1002/jlcr.3080

upstream raw materials:

<2-2H2>glycine

N-(2-hydroxyethyl-1,1,2,2-⁽²⁾H₄)-5Z,8Z,11Z,14Z-eicosatetraenamide

Downstream raw materials:

2-bromoethyl-1,1,2,2,-d₄-amine hydrobromide

oleoyl ethanolamide-d4

palmitoyl ethanolamide-d4

4,7,10,13,16,19-docosahexaenoyl ethanolamide-d4