Grundinformationen
- Standard-SMILES
CN(C)[C@H]1CCNC1- InChIKey
AVAWMINJNRAQFS-LURJTMIESA-N- Summenformel
- C6H14N2
- Durchschnittliche Molmasse
- 114,19 g/mol
- Monoisotopische Masse
- 114,11569846
Namen und Bezeichner
- Bevorzugter Name
- (3S)-(-)-3-(Dimethylamino)pyrrolidine
- IUPAC
- (3S)-N,N-dimethylpyrrolidin-3-amine
- Englischer Name
- (3S)-(-)-3-(DIMETHYLAMINO)PYRROLIDINE
- Summenformel
- C6H14N2
- Molmasse
- 114.19
Namen und Synonyme
Weitere Namen anzeigen
Datenbank-Bezeichner
- CAS
132883-44-4- PubChem CID
- 7019156
- DTXSID
DTXSID90427080- UNII
- 7DNP4SR5XL
- EC Number
- 624-760-3
- Nikkaji
- J382.979K
Eigenschaften
Berechnete Struktureigenschaften
- XLogP
- 0
- Polarare Oberfläche (TPSA)
- 15,3 Ų
- H-Brücken-Donoren
- 1
- H-Brücken-Akzeptoren
- 2
- Frei drehbare Bindungen
- 1
- Schwere Atome
- 8
- Formalladung
- 0
- Komplexität
- 70
Physikochemische Eigenschaften
- Siedepunkt
- 160 °C/760 · 160 °C/760 mmHg (lit.)
- Dichte
- 0.899 g/mL · 0.899 g/mL at 25 °C (lit.)
- Brechungsindex
- 20 · n20/D 1.4650(lit.)
- Flammpunkt
- 125 °F · 125 °F
- storage temp.
- 2 · 2-8°C
- pka
- 9.93 · 9.93±0.10(Predicted)
- Aggregatzustand
- clear liquid
- Farbe
- Colorless to Light yellow
- Wichte
- 0.9 · 0.90
- InChI
- InChI=1S/C6H14N2/c1-8(2)6-3-4-7-5-6/h6-7H,3-5H2,1-2H3/t6-/m0/s1
- InChIKey
- AVAWMINJNRAQFS-LURJTMIESA-N
- SMILES
- N1CC[C@H](N(C)C)C1
- CAS Datenbank
- 132883 · 132883-44-4(CAS DataBase Reference)
Sicherheit und Regulatorisches
GHS-Klassifizierung
GHS Classification
Danger
H226 (97.6%): Flammable liquid and vapor [Warning Flammable liquids];H302 (95.2%): Harmful if swallowed [Warning Acute toxicity, oral];H315 (95.2%): Causes skin irritation [Warning Skin corrosion/irritation];H318 (97.6%): Causes serious eye damage [Danger Serious eye damage/eye irritation];H335 (95.2%): May cause respiratory irritation [Warning Specific target organ toxicity, single exposure; Respiratory tract irritation]
P210, P233, P240, P241, P242, P243, P261, P264, P264+P265, P270, P271, P280, P301+P317, P302+P352, P303+P361+P353, P304+P340, P305+P354+P338, P317, P319, P321, P330, P332+P317, P362+P364, P370+P378, P403+P233, P403+P235, P405, and P501 (click each P-code to see the statement)
Aggregated GHS information provided per 42 reports by companies from 5 notifications to the ECHA C&L Inventory. Each notification may be associated with multiple companies.;Information may vary between notifications depending on impurities, additives, and other factors. The percentage value in parenthesis indicates the notified classification ratio from companies that provide hazard codes. Only hazard codes with percentage values above 10% are shown. For more detailed information, please visit ECHA C&L website.
Gefahrenhinweise
Sicherheitsdaten
- wgk
- 2
- ridadr
- UN 1993 3/PG 3
- hs_code
- 2933998090
- risk_code
- 10-22-37/38-41-38-37
- hazard_code
- Xn
- safety_code
- 26-39
- hazard_class
- 3
- packing_group
- III
- Speicherklasse
- 3 - Flammable liquids
- Hazard Classifications
- Acute Tox. 4 OralEye Dam. 1Flam. Liq. 3Skin Irrit. 2STOT SE 3
Chemie und Industrie
Anwendungen
Verwenden(S)-()-3-(Dimethylamino)pyrrolidine can be used as a reactant in the syntheses of oxadiazolylthiazole and xanthone derivatives of biological importance.
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