Grundinformationen
- Standard-SMILES
CC1(C)CCCC(C)(C)N1O- InChIKey
VUZNLSBZRVZGIK-UHFFFAOYSA-N- Summenformel
- C9H19NO
- Durchschnittliche Molmasse
- 157,25 g/mol
- Monoisotopische Masse
- 157,14666423
Überblick
2,2,6,6-Tetramethyl-1-piperidinol is a member of piperidines.
Namen und Bezeichner
- Bevorzugter Name
- 2,2,6,6-Tetramethylpiperidin-1-ol
- IUPAC
- 1-hydroxy-2,2,6,6-tetramethylpiperidine
- Englischer Name
- 1-Hydroxy-2,2,6,6-tetramethylpiperidine
- Summenformel
- C9H19NO
- Molmasse
- 157.25
Namen und Synonyme
Weitere Namen anzeigen
Datenbank-Bezeichner
- CAS
7031-93-8- PubChem CID
- 549976
- DTXSID
DTXSID60338578- ChEMBL
CHEMBL117747- ChEBI
CHEBI:172380- UNII
- V7P47JWA4V
- EC Number
- 871-122-7
- Nikkaji
- J378.840G
Eigenschaften
Berechnete Struktureigenschaften
- XLogP
- 1,4
- Polarare Oberfläche (TPSA)
- 23,5 Ų
- H-Brücken-Donoren
- 1
- H-Brücken-Akzeptoren
- 2
- Frei drehbare Bindungen
- 0
- Schwere Atome
- 11
- Formalladung
- 0
- Komplexität
- 136
Physikochemische Eigenschaften
- Schmelzpunkt
- 39 · 39-40 °C
- Siedepunkt
- 208.8 · 208.8±7.0 °C(Predicted)
- Dichte
- 0.917 · 0.917±0.06 g/cm3(Predicted)
- storage temp.
- 2 · under inert gas (nitrogen or Argon) at 2-8°C
- Löslichkeit
- Acetonitrile (Slightly), Chloroform (Slightly), Methanol (Slightly)
- Aggregatzustand
- Oil
- pka
- 14.28 · 14.28±0.60(Predicted)
- Farbe
- Orange to Dark Orange
- InChI
- InChI=1S/C9H19NO/c1-8(2)6-5-7-9(3,4)10(8)11/h11H,5-7H2,1-4H3
- InChIKey
- VUZNLSBZRVZGIK-UHFFFAOYSA-N
- SMILES
- N1(O)C(C)(C)CCCC1(C)C
Sicherheit und Regulatorisches
GHS-Klassifizierung
GHS Classification
Warning
H302 (100%): Harmful if swallowed [Warning Acute toxicity, oral]
P261, P264, P264+P265, P270, P271, P280, P301+P317, P302+P352, P304+P340, P305+P351+P338, P319, P321, P330, P332+P317, P337+P317, P362+P364, P403+P233, P405, and P501 (click each P-code to see the statement)
Aggregated GHS information provided per 2 reports by companies from 1 notifications to the ECHA C&L Inventory. Each notification may be associated with multiple companies.
Gefahrenhinweise
Sicherheitsdaten
- Alarmwort
- Warnung
- Gefahrenhinweise
- Code Gefahrenhinweise Gefahrenklasse Abteilung Alarmwort Symbol P-Code H302
Chemie und Industrie
Anwendungen
Verwenden2,2,6,6-Tetramethyl-1-hydroxypiperidine is a reactant used in various synthesis and investigations. It was used as a reactant in the study of predicting organic hydrogen atom transfer rate constants using the Marcus cross relation. 2,2,6,6-Tetramethyl-1-hydroxypiperidine was also used as a reactant in the preparation of ammonia from an iron nitrido complex.
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