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2,2,6,6-Tetramethyl-4-piperidylamin
TEMP · TAD · 4-AMINO-2,2,6,6-TETRAMETHYLPIPERIDINE · 2,2,6,6-tetramethyl-4-piperidinamin · TEMP TAD · Samsorb UV-TAD · TRIACETONEDIAMINE · TIMTEC-BB SBB001789
Identifikatoren & physikalische Daten
| CAS No. | 36768-62-4 |
|---|---|
| Summenformel | C9H20N2 |
| Durchschnittliche Molmasse | 156,27 g/mol |
| Monoisotopische Masse | 156,16264864 g/mol |
| SMILES | CC1(C)CC(N)CC(C)(C)N1 |
| InChIKey | FTVFPPFZRRKJIH-UHFFFAOYSA-N |
| PubChem CID | 37524 |
| ChEMBL | CHEMBL368366 |
| EC No. | 253-197-2 |
| DTXSID | DTXSID3044388 |
| Lokaler Name | 2,2,6,6-Tetramethyl-4-piperidylamin |
Chemische & physikalische Eigenschaften
| XLogP | 0,6 |
|---|---|
| Polarare Oberfläche (TPSA) | 38,1 |
| H-Brücken-Donoren | 2 |
| H-Brücken-Akzeptoren | 2 |
| Frei drehbare Bindungen | 0 |
| Schwere Atome | 11 |
| Formalladung | 0 |
| Komplexität | 134 |
| Food Contact Substances | FCS -> FDA Cumulative Estimated Daily Intake (CEDI) |
| Physical Description | Liquid |
| Collision Cross Section | 135.1 Ų [M+H]+ [CCS Type: DTBuffer gas: N2Ionization: ESI+Dataset: TOXCASTSource Identifier: DTXSID3044388] |
| Schmelzpunkt | 16-18 °C(lit.) |
| Siedepunkt | 188-189 °C(lit.) |
| Dichte | 0.912 g/mL at 25 °C(lit.) |
| Dampfdruck | <=20 hPa (20 °C) |
| Brechungsindex | n20/D 1.470(lit.) |
| Flammpunkt | 162 °F |
| Lagerbedingungen | Store below +30°C. |
| pKa (Säurekonstante) | 10.83±0.10(Predicted) |
| Aggregatzustand | clear liquid |
| Farbe | Colorless to Light orange to Yellow |
| Wichte | 0.912 |
| pH | 12.3 (99g/l, H2O, 20℃) |
| Löslichkeit | soluble |
| BRN | 105038 |
| InChI | 1S/C9H20N2/c1-8(2)5-7(10)6-9(3,4)11-8/h7,11H,5-6,10H2,1-4H3 |
| InChIKey | FTVFPPFZRRKJIH-UHFFFAOYSA-N |
| SMILES | CC1(C)CC(N)CC(C)(C)N1 |
| LogP (Verteilungskoeffizient) | 0.94 at 20℃ |
| Oberflächenspannung | 67.11-68.09mN/m at 1g/L and 20℃ |
| CAS Datenbank | 36768-62-4(CAS DataBase Reference) |
| NIST chemische Informationen | 4-Piperidinamine, 2,2,6,6-tetramethyl-(36768-62-4) |
| EPA chemische Informationen | 4-Piperidinamine, 2,2,6,6-tetramethyl- (36768-62-4) |
Sicherheit & Vorschriften
| GHS-Einstufung | DangerH290 (24.6%): May be corrosive to metals [Warning Corrosive to Metals]P234, P260, P264, P264+P265, P270, P273, P280, P301+P317, P301+P330+P331, P302+P361+P354, P304+P340, P305+P354+P338, P316, P317, P321, P330, P363, P390, P405, P406, and P501 (click each P-code to see the statement)Aggregated GHS information provided per 195 reports by companies from 8 notifications to the ECHA C&L Inventory. Each notification may be associated with multiple companies. |
|---|---|
| Regulatorische Informationen | Regulation (EC) No 1935/2004 (amended)4-Piperidinamine, 2,2,6,6-tetramethyl- is listed on the EPA's Chemical Data Reporting (CDR) system. Manufacturers and importers of 4-Piperidinamine, 2,2,6,6-tetramethyl- are required to report information about their production and use of this chemical to the EPA under the Toxic Substances Control Act (TSCA). (40 eCFR Part 711)Status: Active Update: 24-02-2022 https://echa.europa.eu/registration-dossier/-/registered-dossier/19434-Amino-2,2,6,6-tetramethylpiperidine: Does not have an individual approval but may be used under an appropriate group standard |
| Hazard Classes and Categories | Met. Corr. 1 (24.6%) |
| Wassergefährdungsklasse (WGK) | 2 |
| TSCA-Inventar-Status | TSCA listed |
| UN-Transportnummer | UN 2735 8/PG 3 |
| Zollcode | 29333999 |
| RTECS-Nr. | TM4290100 |
| R-Sätze (R) | 22-36/37/38-34-52/53-41 |
| Toxizität | LD50 orally in Rabbit: 1000 mg/kg |
| Gefahrensymbole | Xn,Xi,C |
| hazard_note | Irritant |
| Sicherheitshinweise (S) | 26-36/37-45-36/37/39-61 |
| Gefahrenklasse | 8Acute Tox. 4 OralAquatic Chronic 3Met. Corr. 1Skin Corr. 1C |
| Verpackungsgruppe | III |
| Lagerklasse | 8A - Combustible corrosive hazardous materials |
| Selbstentzündungstemperatur | 300 °C |
Anwendungen & Verwendung
Verwenden
Triacetonediamine have been investigated as new anticancer drugs with high activity and low toxicity.