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N-(2-Chlorethyl)-N-ethylanilin
emery5770 · N-Chloroethyl-N-ethy · ethyl(chloroethyl)aniline · N-Chlorethyl-N-ethylanilin · 4-chloro-n,n-diethyl-anilin · N-CHLOROETHYL-N-ETHYLANILINE · N-ETHYL-N-CHLOROETHYL ANILINE · 2-(n-ethylanilino)ethylchloride
Identifikatoren & physikalische Daten
| CAS No. | 92-49-9 |
|---|---|
| Summenformel | C10H14ClN |
| Durchschnittliche Molmasse | 183,68 g/mol |
| Monoisotopische Masse | 183,08147713 g/mol |
| SMILES | CCN(CCCl)c1ccccc1 |
| InChIKey | DBDNQNARCHWMSP-UHFFFAOYSA-N |
| PubChem CID | 7093 |
| EC No. | 202-159-3 |
| DTXSID | DTXSID6052615 |
| Lokaler Name | N-(2-Chlorethyl)-N-ethylanilin |
Chemische & physikalische Eigenschaften
| XLogP | 3,4 |
|---|---|
| Polarare Oberfläche (TPSA) | 3,2 |
| H-Brücken-Donoren | 0 |
| H-Brücken-Akzeptoren | 1 |
| Frei drehbare Bindungen | 4 |
| Schwere Atome | 12 |
| Formalladung | 0 |
| Komplexität | 110 |
| Stoffklassen | Nitrogen Compounds -> Other Aromatics (Nitrogen) |
| Color/Form | NEEDLES FROM ALCOHOL |
| Löslichkeit | SOL IN HOT ALCOHOL |
| Siedepunkt | 251-253 °C302.39°C (rough estimate) |
| Decomposition | When heated to decomposition it emits toxic vapors of /Nitrogen Oxides and Hydrogen Chloride/. |
| Schmelzpunkt | 45.5-46.5 °C46°C |
| Physical Description | Solid[HSDB] |
| Dichte | 1.0821 (rough estimate) |
| Brechungsindex | 1.6100 (estimate) |
| pKa (Säurekonstante) | 5.52±0.50(Predicted) |
| InChI | InChI=1S/C10H14ClN/c1-2-12(9-8-11)10-6-4-3-5-7-10/h3-7H,2,8-9H2,1H3 |
| InChIKey | DBDNQNARCHWMSP-UHFFFAOYSA-N |
| SMILES | C1(N(CCCl)CC)=CC=CC=C1 |
| CAS Datenbank | 92-49-9(CAS DataBase Reference) |
| EPA chemische Informationen | N-Ethyl-N-(2-chloroethyl)aniline (92-49-9) |
Sicherheit & Vorschriften
| GHS-Einstufung | DangerH301 (100%): Toxic if swallowed [Danger Acute toxicity, oral]P262, P264, P270, P280, P301+P316, P302+P352, P316, P321, P330, P361+P364, P405, and P501 (click each P-code to see the statement)Aggregated GHS information provided per 37 reports by companies from 1 notifications to the ECHA C&L Inventory. Each notification may be associated with multiple companies. |
|---|---|
| Regulatorische Informationen | Chemical: Benzenamine, N-(2-chloroethyl)-N-ethyl- |
| Gefahrenübersicht | Emergency treatment: Mustard gas[HSDB] Corrosive to skin[RTECS] See Nitrogen mustard (HN-1). |
| Hazard Classes and Categories | Acute Tox. 3 (100%) |
| Entsorgungsverfahren | SRP: At the time of review, criteria for land treatment or burial (sanitary landfill) disposal practices are subject to significant revision. Prior to implementing land disposal of waste residue (including waste sludge), consult with environmental regulatory agencies for guidance on acceptable disposal practices. |
| Unerwünschte Wirkungen | Dermatotoxin - Skin burns. |
| TSCA Test Submissions | N-(2-chloroethyl)-N-ethylaniline was evaluated for acute dermal toxicity in 4 groups of 4 New Zealand White rabbits (sex not indicated) administered 0.100, 0.215, 0.464, and 1.00 ml/kg bw doses of the test substance to the abdominal skin under occlusive conditions. The skin of 2 rabbits in each group was abraded prior to application of the test substance. Animals were observed for 14 days following treatment. The use of controls was not reported. Mortalities included one at both the 0.215 ml/kg and 0.464 ml/kg levels, and 4 at the 1.00 ml/kg level. The LD50 (and 95% confidence limits) were determined by the moving average method to be 464 ml/kg (0.270 - 0.799). Clinical signs included depression and nasal discharge at the 0.100 and 0.215 levelshunched posture, emaciation, and half closed eyes at the 0.215 l ml/kg level. Additional signs observed at 0.464 ml/kg level included wheezing, diarrhea, excessive salivation, hyperactivity, and exceptionally blue eyes. The single high dose rabbit that survived long enough for observation displayed the additional signs of depressed righting and placement reflexes and labored respiration. Signs of dermal irritation were seen in all treatment groups. Gross necropsy of rabbits that died revealed congested lungs at all levelscongested kidneys at the two highest dose levelsand autolysis, pale livers and stomachs which fell apart when handled at the highest dose.N-(2-chloroethyl)-N-ethylaniline ( CAS # 92-49-9) was evaluated for acute dermal toxicity in 4 male albino rabbits (strain not indicated) exposed to the test substance under occlusive conditions at a dose level of 200 mg/kg body weight for 24 hours. The skin of 2 rabbits was abraded prior to application of the test substance. The use of controls was not reported. All animals died within 24 hrs. No LD50 was determined and no clinical signs were reported. Gross necropsy revealed organs of the thorax and abdomen to be normal. |
| Non-Human Toxicity Excerpts | ETHYLPHENYL-2-CHLOROETHYLAMINE, A MONOFUNCTIONAL MUSTARD WAS TESTED IN VIVO AGAINST WALKER CARCINOMA 259 IN RATS AND FOUND TO BE INACTIVE.Poison by intraperitoneal and skin contact routes. Moderately toxic by ingestion. |
| TSCA-Inventar-Status | TSCA listed |
| Gefahrstoffdaten | 92-49-9(Hazardous Substances Data) |
Anwendungen & Verwendung
Verwenden
N-Chloroethyl-N-ethylaniline is used as an intermediate in the synthesis of dyes as an aniline organic compound.