Grundinformationen
- Standard-SMILES
CC1(C)CCCC(C)(C)N1- InChIKey
RKMGAJGJIURJSJ-UHFFFAOYSA-N- Summenformel
- C9H19N
- Durchschnittliche Molmasse
- 141,25 g/mol
- Monoisotopische Masse
- 141,15174961
Namen und Bezeichner
- Bevorzugter Name
- 2,2,6,6-Tetramethylpiperidine
- IUPAC
- 2,2,6,6-tetramethylpiperidine
- Lokaler Name
- 2,2,6,6-Tetramethylpiperidin
- Englischer Name
- 2,2,6,6-Tetramethylpiperidine
- Summenformel
- C9H19N
- Molmasse
- 141.25
Namen und Synonyme
Weitere Namen anzeigen
Datenbank-Bezeichner
- CAS
768-66-1- PubChem CID
- 13035
- DTXSID
DTXSID0061113- ChEMBL
CHEMBL2448812- UNII
- 44N9S1YCFM
- EC Number
- 212-199-3
- Nikkaji
- J1.732I
Eigenschaften
Berechnete Struktureigenschaften
- XLogP
- 2,1
- Polarare Oberfläche (TPSA)
- 12 Ų
- H-Brücken-Donoren
- 1
- H-Brücken-Akzeptoren
- 1
- Frei drehbare Bindungen
- 0
- Schwere Atome
- 10
- Formalladung
- 0
- Komplexität
- 111
Experimentelle und physikochemische Eigenschaften
Physikochemische Eigenschaften
- Schmelzpunkt
- -59 °C · -59°C
- Siedepunkt
- 152 °C · 152 °C (lit.)
- Dichte
- 0.837 g/mL · 0.837 g/mL at 25 °C (lit.)
- Dampfdruck
- 14 hPa · 14 hPa (39 °C)
- Brechungsindex
- 20 · n20/D 1.445(lit.)
- Flammpunkt
- 76 °F · 76 °F
- storage temp.
- 30 °C · Store below +30°C.
- Löslichkeit
- MISCIBLE
- pka
- 11.07 · 11.07(at 25℃)
- Aggregatzustand
- Liquid
- Wichte
- 0.837 · 0.837
- Farbe
- Clear colorless to yellow
- Wasserlöslichkeit
- MISCIBLE
- BRN
- 103296 · 103296
- InChI
- 1S/C9H19N/c1-8(2)6-5-7-9(3,4)10-8/h10H,5-7H2,1-4H3
- InChIKey
- RKMGAJGJIURJSJ-UHFFFAOYSA-N
- SMILES
- CC1(C)CCCC(C)(C)N1
- CAS Datenbank
- 768 · 768-66-1(CAS DataBase Reference)
- NIST chemische Informationen
- 2 · Piperidine, 2,2,6,6-tetramethyl-(768-66-1)
- EPA chemische Informationen
- 2 · Piperidine, 2,2,6,6-tetramethyl- (768-66-1)
Sicherheit und Regulatorisches
GHS-Klassifizierung
GHS Classification
Danger
H226 (97.1%): Flammable liquid and vapor [Warning Flammable liquids]
P210, P233, P240, P241, P242, P243, P260, P261, P264, P264+P265, P270, P271, P280, P301+P316, P301+P317, P301+P330+P331, P302+P352, P302+P361+P354, P303+P361+P353, P304+P340, P305+P351+P338, P305+P354+P338, P316, P317, P319, P321, P330, P332+P317, P337+P317, P362+P364, P363, P370+P378, P403+P233, P403+P235, P405, and P501 (click each P-code to see the statement)
Aggregated GHS information provided per 102 reports by companies from 23 notifications to the ECHA C&L Inventory. Each notification may be associated with multiple companies.
Gefahrenhinweise
Regulatory Information
Chemical: Piperidine, 2,2,6,6-tetramethyl-
Status: Active Update: 11-05-2017 https://echa.europa.eu/registration-dossier/-/registered-dossier/19475
2,2,6,6-Tetramethylpiperidine: Does not have an individual approval but may be used under an appropriate group standard
Hazards Summary
Rats demonstrated effects possibly indicative of neurotoxicity in all test groups of acute inhalation study and high dose group (500 mg/kg) of acute oral study; [EPA - TSCATS] A skin and strong eye irritant; Toxic by ingestion; [Sigma-Aldrich MSDS] See Piperidine.
Toxikologische Informationen
Sicherheitsdaten
- wgk
- 2
- tsca
- TSCA listed
- ridadr
- UN 1992 3/PG 3
- hs_code
- 29333999
- RTECS-Nr.
- TN4220000
- risk_code
- 10-22-36/37/38
- Toxizität
- LD50 orally in Rabbit: 500 mg/kg
- hazard_code
- Xn,F,C
- safety_code
- 26-37/39-16
- hazard_class
- 3
- packing_group
- III
- Speicherklasse
- 3 - Flammable liquids
- Hazard Classifications
- Acute Tox. 4 OralEye Dam. 1Flam. Liq. 3Met. Corr. 1Skin Corr. 1ASTOT SE 3
- Selbstentzündungstemperatur
- 290 °C
Chemie und Industrie
Verwendung und Herstellung
Anwendungen
Verwenden2,2,6,6-Tetramethylpiperidine is used in the syntheses of HMP-Y1, Hibarimicinone and HMP-P1, tyrosine kinase inhibitors.
Darstellung
synthetischeMany routes for the synthesis of TMP have been reported. One method starts with a conjugate addition reaction of ammonia to phorone. The intermediate triacetone amine is then reduced in a Wolff-Kishner reaction.
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