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N-(2-Hydroxyethyl)ethylendiamintriessigsure
HEDTA · HOEDTA · HEEDTA · detarol · EDTA-OH · VERSENOL · cheldmacid · hamp-olacid

Identifikatoren & physikalische Daten
| CAS No. | 139-89-9 |
|---|---|
| Summenformel | C10H18N2O7 |
| Durchschnittliche Molmasse | 278,26 g/mol |
| Monoisotopische Masse | 278,11140092 g/mol |
| SMILES | O=C(O)CN(CCO)CCN(CC(=O)O)CC(=O)O |
| InChIKey | URDCARMUOSMFFI-UHFFFAOYSA-N |
| PubChem CID | 8773 |
| ChEMBL | CHEMBL1620428 |
| EC No. | 205-381-9 |
| DTXSID | DTXSID1059737 |
| Lokaler Name | N-(2-Hydroxyethyl)ethylendiamintriessigsure |
Chemische & physikalische Eigenschaften
| XLogP | -6,2 |
|---|---|
| Polarare Oberfläche (TPSA) | 139 |
| H-Brücken-Donoren | 4 |
| H-Brücken-Akzeptoren | 9 |
| Frei drehbare Bindungen | 11 |
| Schwere Atome | 19 |
| Formalladung | 0 |
| Komplexität | 305 |
| Stoffklassen | Other Uses -> Chelating Agents |
| Kosmetika | Cosmetic ingredients (HEDTA) -> CIR (Cosmetic Ingredient Review)ChelatingAbsorbentBulkingViscosity controllingOpacifying |
| pH | pH of a 1 wt% solution = 11.2 |
| Dichte | 1.2851.285 @25 °C1.3300 (rough estimate) |
| Color/Form | SOLID |
| Löslichkeit | Insoluble in most organic solventsIn water, 480 g/L at 20 °CSOL IN WATER AND METHANOL3 M NaOH: 0.1 M, clear, colorless |
| Flammpunkt | Flash point: 100 °C (closed cup) |
| Schmelzpunkt | 288 °C (hydate)159 °C212 °C (dec.)(lit.) |
| Food Contact Substances | FCS -> FDA Inventory of Food Contact Substances Listed in 21 CFRFCS -> FDA Inventory of Effective Food Contact Substance (FCS) Notifications |
| Physical Description | LiquidSolid[Hawley] White odorless powder[MSDSonline]Odorless crystalline powder |
| Other Experimental Properties | Stability Constants [Table#5466]Forms strong 1:1 ferric chelates which will then chelate other heavy metal or alkaline earth ionsPerma Kleer 120: Liquid form, 41% min. solids, with flash point >200 °F. |
| Siedepunkt | 421.08°C (rough estimate) |
| Dampfdruck | 0.01Pa at 20℃ |
| Brechungsindex | 1.4550 (estimate) |
| Lagerbedingungen | Inert atmosphere,Room Temperature |
| Aggregatzustand | powder to crystal |
| pKa (Säurekonstante) | pK1:2.39pK2:5.37pK3:9.93 (25°C) |
| Farbe | White to Almost white |
| BRN | 1804795 |
| Kosmetik-Inhaltsstoffe Funktionen | BULKINGCHELATINGABSORBENTOPACIFYINGVISCOSITY CONTROLLING |
| InChI | 1S/C10H18N2O7/c13-4-3-11(5-8(14)15)1-2-12(6-9(16)17)7-10(18)19/h13H,1-7H2,(H,14,15)(H,16,17)(H,18,19) |
| InChIKey | URDCARMUOSMFFI-UHFFFAOYSA-N |
| SMILES | OCCN(CCN(CC(O)=O)CC(O)=O)CC(O)=O |
| LogP (Verteilungskoeffizient) | -4.65 at 20℃ |
| CAS Datenbank | 150-39-0(CAS DataBase Reference) |
| EPA chemische Informationen | (2-Hydroxyethyl)ethylenediaminetriacetic acid (150-39-0) |
Sicherheit & Vorschriften
| GHS-Einstufung | This chemical does not meet GHS hazard criteria for 0.2% (2 of 938) of reports.DangerH302 (30.3%): Harmful if swallowed [Warning Acute toxicity, oral]P264, P264+P265, P270, P273, P280, P301+P317, P302+P352, P305+P351+P338, P305+P354+P338, P317, P321, P330, P332+P317, P337+P317, P362+P364, P391, and P501 (click each P-code to see the statement)Aggregated GHS information provided per 938 reports by companies from 15 notifications to the ECHA C&L Inventory. Each notification may be associated with multiple companies. |
|---|---|
| Regulatorische Informationen | Chemical: Glycine, N-[2-[bis(carboxymethyl)amino]ethyl]-N-(2-hydroxyethyl)-Chemical: Glycine, N-[2-[bis(carboxymethyl)amino]ethyl]-N-(2-hydroxyethyl)-, trisodium saltGlycine, N-[2-[bis(carboxymethyl)amino]ethyl]-N-(2-hydroxyethyl)-, sodium salt (1:3) is listed on the EPA's Chemical Data Reporting (CDR) system. Manufacturers and importers of Glycine, N-[2-[bis(carboxymethyl)amino]ethyl]-N-(2-hydroxyethyl)-, sodium salt (1:3) are required to report information about their production and use of this chemical to the EPA under the Toxic Substances Control Act (TSCA). (40 eCFR Part 711)Glycine, N-[2-[bis(carboxymethyl)amino]ethyl]-N-(2-hydroxyethyl)- is listed on the EPA's Chemical Data Reporting (CDR) system. Manufacturers and importers of Glycine, N-[2-[bis(carboxymethyl)amino]ethyl]-N-(2-hydroxyethyl)- are required to report information about their production and use of this chemical to the EPA under the Toxic Substances Control Act (TSCA). (40 eCFR Part 711)REACH registered substance: N-(2-hydroxyethyl)ethylenediaminetriacetic acid (EC: 205-759-3)REACH registered substance: Trisodium 2-(carboxylatomethyl(2-hydroxyethyl)amino)ethyliminodi(acetate) (EC: 205-381-9) |
| Weitere Sicherheitsinformationen | IMAP assessments - Glycine, N-[2-[bis(carboxymethyl)amino]ethyl]-N-(2-hydroxyethyl)-, trisodium salt: Human health tier I assessment |
| Gefahrenübersicht | Causes convulsions and other liver changes in intraperitoneal lethal-dose studies of rats[RTECS] An irritantEffects in high-dose animal studies include convulsions[MSDSonline]Emergency treatment: Irritants[HSDB] An irritant |
Anwendungen & Verwendung
Verwenden
N-(2-Hydroxyethyl)ethylenediaminetriacetic acid is a chelating agent.