Grundinformationen
- Standard-SMILES
CC(=O)O.CC(=O)O.c1ccc(CNCCNCc2ccccc2)cc1- InChIKey
MTRNNCLQPVCDLF-UHFFFAOYSA-N- Summenformel
- C16H20N2.2C2H4O2
- Durchschnittliche Molmasse
- 360,4 g/mol
- Monoisotopische Masse
- 360,20490738
Namen und Bezeichner
- Bevorzugter Name
- 1,2-Ethanediamine, N1,N2-bis(phenylmethyl)-, acetate (1:2)
- IUPAC
- acetic acid;N,N'-dibenzylethane-1,2-diamine
Namen und Synonyme
122-75-8N,N'-Dibenzylethylenediamine diacetateBenzathine diacetate1,2-Ethanediamine, N,N'-bis(phenylmethyl)-, diacetate1,2-Ethanediamine, N1,N2-bis(phenylmethyl)-, acetate (1:2)X18B8X2C22DTXSID40883314NSC-33274RefChem:411930DTXCID901022852204-572-4N1,N2-Dibenzylethane-1,2-diamine diacetate
Weitere Namen anzeigen
N,N'-Dibenzyl ethylenediamine diacetateDBED diacetateMFCD00040588C20H28N2O4N,N'-Dibenzylethylenediamine Diacetate Salt1,2-Di(benzylamino)ethane diacetateacetic acid;N,N'-dibenzylethane-1,2-diamineNSC-81591
Datenbank-Bezeichner
- CAS
122-75-8- PubChem CID
- 31228
- DTXSID
DTXSID40883314- UNII
- X18B8X2C22
- EC Number
- 204-572-4
Eigenschaften
Berechnete Struktureigenschaften
- Polarare Oberfläche (TPSA)
- 98,7 Ų
- H-Brücken-Donoren
- 4
- H-Brücken-Akzeptoren
- 6
- Frei drehbare Bindungen
- 7
- Schwere Atome
- 26
- Formalladung
- 0
- Komplexität
- 202
Sicherheit und Regulatorisches
GHS-Klassifizierung
GHS Classification
Warning
H302 (100%): Harmful if swallowed [Warning Acute toxicity, oral]
P264, P270, P301+P317, P330, and P501 (click each P-code to see the statement)
Aggregated GHS information provided per 65 reports by companies from 2 notifications to the ECHA C&L Inventory.
Gefahrenhinweise
Regulatory Information
Chemical: 1,2-Ethanediamine, N,N'-bis(phenylmethyl)-, diacetate
Status: Active Update: 29-04-2019 https://echa.europa.eu/registration-dossier/-/registered-dossier/12715
1,2-Ethanediamine, N,N'-bis(phenylmethyl)-, diacetate: Does not have an individual approval but may be used under an appropriate group standard
Hazard Classes and CategoriesAcute Tox. 4 (100%)
Chemie und Industrie
Verwendung und Herstellung
General Manufacturing Information1,2-Ethanediamine, N1,N2-bis(phenylmethyl)-, acetate (1:2): INACTIVE
Zugehörige Reaktionen
9
Verknüpfte Notizen
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