Grundinformationen
- Standard-SMILES
CN1CCCC1CCN- InChIKey
PNHGJPJOMCXSKN-UHFFFAOYSA-N- Summenformel
- C7H16N2
- Durchschnittliche Molmasse
- 128,22 g/mol
- Monoisotopische Masse
- 128,13134851
Überblick
1-Methylpyrrolidine-2-ethylamine is a pyrrolidine substituted by a methyl group at position 1 and bearing an ethylamine at position 2. It is functionally related to an ethylamine.
Namen und Bezeichner
- Bevorzugter Name
- 2-(2-Aminoethyl)-1-methylpyrrolidine
- IUPAC
- 2-(1-methylpyrrolidin-2-yl)ethanamine
- Lokaler Name
- 1-Methylpyrrolidin-2-ethylamin
- Englischer Name
- 2-(2-Aminoethyl)-1-methylpyrrolidine
- Summenformel
- C7H16N2
- Molmasse
- 128.22
Namen und Synonyme
2-(2-Aminoethyl)-1-methylpyrrolidine51387-90-71-Methylpyrrolidine-2-ethylamineDTXSID4012913972-[2-Aminoethyl]-1-methylpyrrolidineRefChem:434680DTXCID40892840257-169-02-(1-methylpyrrolidin-2-yl)ethanamine2-Pyrrolidineethanamine, 1-methyl-MFCD000031752-(1-Methylpyrrolidin-2-Yl)Ethan-1-Amine
Weitere Namen anzeigen
2-(2-Aminoethyl)-1-methyl2-(2-Aminoethyl)-1-methylpyN-Methyl-2-(2-aMinoethyl)pyr2-AMinoethyl-1-MethylpyrrolidineN-Methyl-2-Pyrrolidineethanamine1-methyl-2-(aminoethyl)pyrrolidine
2-(1-methylpyrrolidin-2-yl)ethylamine2-(2'-Aminoethyl)-1-N-methylpyrrolidine2-(1-Methyl-2-pyrrolidinyl)ethylamine1-Methylpyrrolidine-2-ethanamine(R)-1-METHYL-2-PYRROLIDINEETHANAMINE1-METHYL-2-(2-AMINOETHYL)PYRROLIDINE1-Methyl-2-pyrrolidineethanamineN-Methyl-2-(2-aminoethyl)pyrrolidine
Datenbank-Bezeichner
- CAS
51387-90-7- PubChem CID
- 98388
- DTXSID
DTXSID401291397- ChEBI
CHEBI:234484- EC Number
- 257-169-0
- Nikkaji
- J236.383F
Eigenschaften
Berechnete Struktureigenschaften
- XLogP
- 0,2
- Polarare Oberfläche (TPSA)
- 29,3 Ų
- H-Brücken-Donoren
- 1
- H-Brücken-Akzeptoren
- 2
- Frei drehbare Bindungen
- 2
- Schwere Atome
- 9
- Formalladung
- 0
- Komplexität
- 83
Physikochemische Eigenschaften
- Siedepunkt
- 152.7 · 152.7±8.0 °C(Predicted)
- Dichte
- 0.885 g/mL · 0.885 g/mL at 25 °C (lit.)
- Brechungsindex
- 20 · n20/D 1.4684(lit.)
- Flammpunkt
- 149 °F · 149 °F
- storage temp.
- Keep in dark place,Inert atmosphere,Room temperature
- Löslichkeit
- Chloroform (Slightly), Methanol (Slightly)
- pka
- 10.34 · 10.34±0.40(Predicted)
- Aggregatzustand
- Powder
- Farbe
- Light beige to light brown
- InChI
- InChI=1S/C7H16N2/c1-9-6-2-3-7(9)4-5-8/h7H,2-6,8H2,1H3
- InChIKey
- PNHGJPJOMCXSKN-UHFFFAOYSA-N
- SMILES
- N1(C)CCCC1CCN
- CAS Datenbank
- 51387 · 51387-90-7(CAS DataBase Reference)
Sicherheit und Regulatorisches
GHS-Klassifizierung
GHS Classification
Danger
H302 (97.7%): Harmful if swallowed [Warning Acute toxicity, oral]
P261, P264, P264+P265, P270, P271, P280, P301+P317, P302+P352, P304+P340, P305+P354+P338, P317, P319, P321, P330, P332+P317, P362+P364, P403+P233, P405, and P501 (click each P-code to see the statement)
Aggregated GHS information provided per 43 reports by companies from 5 notifications to the ECHA C&L Inventory. Each notification may be associated with multiple companies.
Gefahrenhinweise
Hazard Classes and CategoriesAcute Tox. 4 (97.7%)
Sicherheitsdaten
- wgk
- 2
- ridadr
- 2735
- hs_code
- 29339900
- risk_code
- 22-37/38-41
- hazard_code
- Xn
- safety_code
- 26-39
- hazard_class
- 8
- packing_group
- III
- Speicherklasse
- 10 - Combustible liquids
- Hazard Classifications
- Acute Tox. 4 OralEye Dam. 1Skin Irrit. 2STOT SE 3
Chemie und Industrie
Anwendungen
Verwenden2-(2-Aminoethyl)-1-methylpyrrolidine is used as an electrochemiluminescence probe within microfluidic chip for ECL detection. 2-(2-Aminoethyl)-1-methylpyrrolidine is also used in chemical microarrays to identify ligands that bind pathogenic cells.
Vor- und nachgelagerte Produkte
Vorgelagerte Rohstoffe
Zugehörige Reaktionen
91
Verknüpfte Notizen
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