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2-Diisopropylaminoethanol
DIISOPROPYLAMINOETHANOL · 2-(DIISOPROPYLAMINO)ETHANOL · n,n-diisopropyl · Diisopropylethanolamin · Diisopropylethanolamine · DI-ISO-PROPYLAMINETHANOL · Acotinamide impurity c-5 · N,N-DIISOPROYLETHANOAMINE
Identifikatoren & physikalische Daten
| CAS No. | 96-80-0 |
|---|---|
| Summenformel | C8H19NO |
| Durchschnittliche Molmasse | 145,24 g/mol |
| Monoisotopische Masse | 145,14666423 g/mol |
| SMILES | CC(C)N(CCO)C(C)C |
| InChIKey | ZYWUVGFIXPNBDL-UHFFFAOYSA-N |
| PubChem CID | 7313 |
| ChEMBL | CHEMBL122184 |
| EC No. | 202-536-2 |
| DTXSID | DTXSID6021822 |
| Lokaler Name | 2-Diisopropylaminoethanol |
Chemische & physikalische Eigenschaften
| XLogP | 1,2 |
|---|---|
| Polarare Oberfläche (TPSA) | 23,5 |
| H-Brücken-Donoren | 1 |
| H-Brücken-Akzeptoren | 2 |
| Frei drehbare Bindungen | 4 |
| Schwere Atome | 10 |
| Formalladung | 0 |
| Komplexität | 73,3 |
| Stoffklassen | Corrosives |
| SpringerMaterials Properties | Optical coefficient |
| Dichte | 0.826 @25 °C0.826 g/mL at 25 °C(lit.) |
| Flammpunkt | 175 °F (NFPA, 2010)158 °F |
| Siedepunkt | 190 °C @760 [mm Hg]187-192 °C(lit.) |
| Physical Description | N,n-diisopropyl ethanolamine appears as a colorless liquid. Slightly soluble in water and less dense than water. Severely irritates skin and eyes. Used to make other chemicals. |
| Schmelzpunkt | -39 °C |
| Dampfdichte | 5 (vs air) |
| Dampfdruck | <1 mm Hg ( 20 °C) |
| Brechungsindex | n20/D 1.442(lit.) |
| Lagerbedingungen | Refrigerator, under inert atmosphere |
| Löslichkeit | Chloroform (Soluble), Methanol (Slightly) |
| Aggregatzustand | Oil |
| pKa (Säurekonstante) | 14.75±0.10(Predicted) |
| Farbe | Light Yellow to Yellow |
| BRN | 1697955 |
| Henry-Konstante | 2.2×100 mol/(m3Pa) at 25℃, Du et al. (2017) |
| Stabilität | Stable. Incompatible with acids, strong oxidizing agents. |
| InChIKey | ZYWUVGFIXPNBDL-UHFFFAOYSA-N |
| CAS Datenbank | 96-80-0(CAS DataBase Reference) |
| NIST chemische Informationen | (Diisopropylamino)ethanol(96-80-0) |
| EPA chemische Informationen | Ethanol, 2-[bis(1-methylethyl)amino]- (96-80-0) |
Sicherheit & Vorschriften
| GHS-Einstufung | DangerH302 (100%): Harmful if swallowed [Warning Acute toxicity, oral]P260, P261, P262, P264, P264+P265, P270, P271, P273, P280, P301+P317, P301+P330+P331, P302+P352, P302+P361+P354, P304+P340, P305+P354+P338, P316, P317, P321, P330, P361+P364, P363, P403+P233, P405, and P501 (click each P-code to see the statement)Aggregated GHS information provided per 182 reports by companies from 5 notifications to the ECHA C&L Inventory. Each notification may be associated with multiple companies. |
|---|---|
| Regulatorische Informationen | Chemical: Ethanol, 2-[bis(1-methylethyl)amino]-Status: Active Update: 25-01-2022 https://echa.europa.eu/registration-dossier/-/registered-dossier/21097Ethanol, 2-bis(1-methylethyl)amino-: Does not have an individual approval but may be used under an appropriate group standardThe New Jersey Worker and Community Right to Know Act requires public and private employers to provide information about hazardous substances at their workplaces. (N.J.S.A. 34:5A-1 et. seq.) |
| DOT-Kennzeichnung | Corrosive |
| Brandgefahren | Excerpt from ERG Guide 154 [Substances - Toxic and/or Corrosive (Non-Combustible)]: |
| Gesundheitsgefahren | Excerpt from ERG Guide 154 [Substances - Toxic and/or Corrosive (Non-Combustible)]: |
| Reaktive Gruppe | Alcohols and Polyols |
| Reactivity Profile | N,N-DIISOPROPYL ETHANOLAMINE is an amino alcohol. Neutralizes acids in exothermic reactions to form salts plus water. May be incompatible with isocyanates, halogenated organics, peroxides, phenols (acidic), epoxides, anhydrides, and acid halides. Flammable gaseous hydrogen is generated in combination with strong reducing agents, such as hydrides. |
| Air and Water Reactions | Slightly soluble in water. |
| Hazard Classes and Categories | Acute Tox. 4 (100%)Corrosives, Flammable agents - 2nd degree |
| Brandbekämpfung | Excerpt from ERG Guide 154 [Substances - Toxic and/or Corrosive (Non-Combustible)]: |
| Erste Hilfe | Excerpt from ERG Guide 154 [Substances - Toxic and/or Corrosive (Non-Combustible)]: |
| Freisetung ohne Brand | Excerpt from ERG Guide 154 [Substances - Toxic and/or Corrosive (Non-Combustible)]: |
| Isolation and Evacuation | Excerpt from ERG Guide 154 [Substances - Toxic and/or Corrosive (Non-Combustible)]: |
| Protective Action Criteria (PAC) | 1.5 [mg/m3]17 [mg/m3]99 [mg/m3] |
| Personal Protective Equipment (PPE) | Excerpt from ERG Guide 154 [Substances - Toxic and/or Corrosive (Non-Combustible)]: |
| F | 9-23 |
| Wassergefährdungsklasse (WGK) | 2 |
| TSCA-Inventar-Status | TSCA listed |
| UN-Transportnummer | UN 2922 8/PG 2 |
| RTECS-Nr. | KK5950000 |
| R-Sätze (R) | 20/22-24-34 |
| Gefahrensymbole | T |
| Sicherheitshinweise (S) | 26-36/37/39-45 |
| Gefahrenklasse | 3.2 |
| Verpackungsgruppe | III |
Anwendungen & Verwendung
Verwenden
2-(Diisopropylamino)ethanol is used in method for preparing Fluvardiol catalyzed by carbonyl reductase.