Grundinformationen
- Standard-SMILES
Cl.ClCCNCCCl- InChIKey
YMDZDFSUDFLGMX-UHFFFAOYSA-N- Summenformel
- C4H9Cl2N.ClH
- Durchschnittliche Molmasse
- 178,48 g/mol
- Monoisotopische Masse
- 176,98788236
Namen und Bezeichner
- Bevorzugter Name
- Bis(2-chloroethyl)amine hydrochloride
- IUPAC
- 2-chloro-N-(2-chloroethyl)ethanamine;hydrochloride
- Lokaler Name
- Bis(2-chlorethyl)aminhydrochlorid
- Englischer Name
- Bis(2-chloroethyl)amine hydrochloride
- Summenformel
- C4H10Cl3N
- Molmasse
- 178.49
Namen und Synonyme
Weitere Namen anzeigen
Datenbank-Bezeichner
- CAS
821-48-7- PubChem CID
- 522769
- DTXSID
DTXSID3052567- UNII
- LY407360DG
- EC Number
- 212-479-5
Eigenschaften
Berechnete Struktureigenschaften
- Polarare Oberfläche (TPSA)
- 12 Ų
- H-Brücken-Donoren
- 2
- H-Brücken-Akzeptoren
- 1
- Frei drehbare Bindungen
- 4
- Schwere Atome
- 8
- Formalladung
- 0
- Komplexität
- 28,9
Experimentelle und physikochemische Eigenschaften
Physikochemische Eigenschaften
- Schmelzpunkt
- 212 · 212-214 °C(lit.)
- storage temp.
- 30 °C · Store below +30°C.
- Löslichkeit
- 100 g/l · >100g/l
- Aggregatzustand
- Crystalline Powder
- Farbe
- White to beige
- Wasserlöslichkeit
- SOLUBLE
- BRN
- 3550356 · 3550356
- InChI
- InChI=1S/C4H9Cl2N.ClH/c5-1-3-7-4-2-6;/h7H,1-4H2;1H
- InChIKey
- YMDZDFSUDFLGMX-UHFFFAOYSA-N
- SMILES
- N(CCCl)CCCl.Cl
- CAS Datenbank
- 821 · 821-48-7(CAS DataBase Reference)
- NIST chemische Informationen
- 2 · 2,2'-Dichlorodiethylamine hydrochloride(821-48-7)
- EPA chemische Informationen
- 2 · Ethanamine, 2-chloro-N-(2-chloroethyl)-, hydrochloride (821-48-7)
Sicherheit und Regulatorisches
GHS-Klassifizierung
GHS Classification
Danger
H290 (16.2%): May be corrosive to metals [Warning Corrosive to Metals]
P203, P234, P260, P261, P264, P264+P265, P270, P271, P280, P301+P317, P301+P330+P331, P302+P352, P302+P361+P354, P304+P340, P305+P351+P338, P305+P354+P338, P316, P318, P319, P321, P330, P332+P317, P337+P317, P362+P364, P363, P390, P403+P233, P405, P406, and P501 (click each P-code to see the statement)
Aggregated GHS information provided per 68 reports by companies from 16 notifications to the ECHA C&L Inventory. Each notification may be associated with multiple companies.
Gefahrenhinweise
Regulatory Information
Chemical: Ethanamine, 2-chloro-N-(2-chloroethyl)-, hydrochloride
Status: Active Update: 07-03-2019 https://echa.europa.eu/registration-dossier/-/registered-dossier/19951
Bis(2-chloroethyl)ammonium chloride: Does not have an individual approval but may be used under an appropriate group standard
Hazards Summary
Causes burns and lachrymation; Inhalation may cause corrosive injuries to upper respiratory tract and lungs; May cause skin sensitization; Harmful by ingestion; Toxic by inhalation; Risk of irreversible adverse health effects; Suspected mutagen; Reproductive effects observed in experimental animals; [Alfa Aesar MSDS] See 1-Chloro-2-(diethylamine)ethane hydrochloride, N,N-Dimethylaminoethyl chloride hydrochloride, and 2-Chloro-N,N-dimethyl-1-propanamine hydrochloride. Search for (821-48-7[EC/RN Number]) AND (allergic OR dermatitis OR sensitizer OR sensitization): no results; [PubMed]
Toxikologische Informationen
Sicherheitsdaten
- wgk
- 3
- tsca
- TSCA listed
- ridadr
- 2811
- hs_code
- 29211980
- RTECS-Nr.
- IA1225000
- risk_code
- 36/37/38-36-34
- Toxizität
- LD50 orally in Rabbit: 1150 mg/kg
- hazard_code
- Xi,T,C
- hazard_note
- Irritant/Toxic
- safety_code
- 26-45-36/37/39-27
- hazard_class
- 8
- packing_group
- III
- Speicherklasse
- 8A - Combustible corrosive hazardous materials
- Hazard Classifications
- Acute Tox. 4 OralEye Dam. 1Met. Corr. 1Skin Corr. 1B
Chemie und Industrie
Verwendung und Herstellung
Anwendungen
VerwendenBis(2-chloroethyl)amine hydrochloride is used as an intermediate in chemicals synthesis and building block for piperazine derivatives.
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