Grundinformationen
- Standard-SMILES
CN1CCCN(C)CCN(C)CCCN(C)CC1- InChIKey
HRFJEOWVAGSJNW-UHFFFAOYSA-N- Summenformel
- C14H32N4
- Durchschnittliche Molmasse
- 256,43 g/mol
- Monoisotopische Masse
- 256,26269704
Namen und Bezeichner
- Bevorzugter Name
- 1,4,8,11-Tetraazacyclotetradecane, 1,4,8,11-tetramethyl-
- IUPAC
- 1,4,8,11-tetramethyl-1,4,8,11-tetrazacyclotetradecane
- Englischer Name
- 1,4,8,11-Tetramethyl-1,4,8,11-tetraazacyclotetradecane
- Summenformel
- C14H32N4
- Molmasse
- 256.43
Namen und Synonyme
1,4,8,11-Tetramethyl-1,4,8,11-tetraazacyclotetradecane41203-22-91,4,8,11-Tetraazacyclotetradecane, 1,4,8,11-tetramethyl-DTXSID10194126RefChem:73029DTXCID20116617626-243-81,4,8,11-tetramethyl-1,4,8,11-tetrazacyclotetradecaneMFCD00005106Tetramethylcyclam1,4,8,11-TetramethylcyclamSCHEMBL143926
Weitere Namen anzeigen
N,N',N'',N'''-TetramethylcyclamTetraMethyl-1,4,8,11-tetraazacyclot1,5,8,12-Tetramethyl-1,5,8,12-tetraazacyclotetradecane1,4,8,11-Tetramethyl-1,4,8,11-tetraazacyclotetradecane,98%N,N',N'',N'''-Tetramethyl-1,4,8,11-tetraazacyclotetradecane
NIOSH/XA5255700C14H32N4AKOS015851050CS-W012560AS-69568SY048168ST45255266XA52557000
Datenbank-Bezeichner
- CAS
41203-22-9- PubChem CID
- 123502
- DTXSID
DTXSID10194126- EC Number
- 626-243-8
- Nikkaji
- J1.653.673C、J1.653.674A、J367.073B
Eigenschaften
Berechnete Struktureigenschaften
- XLogP
- 0,4
- Polarare Oberfläche (TPSA)
- 13 Ų
- H-Brücken-Donoren
- 0
- H-Brücken-Akzeptoren
- 4
- Frei drehbare Bindungen
- 0
- Schwere Atome
- 18
- Formalladung
- 0
- Komplexität
- 168
Physikochemische Eigenschaften
- Schmelzpunkt
- 38 · 38-42 °C(lit.)
- Siedepunkt
- 130 · 130-135℃ (0.2 Torr)
- Dichte
- 0.9798 · 0.9798 (rough estimate)
- Brechungsindex
- 1.6 · 1.6000 (estimate)
- Flammpunkt
- 230 °F · >230 °F
- storage temp.
- Inert atmosphere,Room Temperature
- pka
- 8.96 · 8.96±0.20(Predicted)
- Aggregatzustand
- crystal
- Farbe
- white waxy
- Wasserlöslichkeit
- Soluble in water.
- BRN
- 1210788 · 1210788
- InChI
- 1S/C14H32N4/c1-15-7-5-8-17(3)13-14-18(4)10-6-9-16(2)12-11-15/h5-14H2,1-4H3
- InChIKey
- HRFJEOWVAGSJNW-UHFFFAOYSA-N
- SMILES
- CN1CCCN(C)CCN(C)CCCN(C)CC1
- CAS Datenbank
- 41203 · 41203-22-9(CAS DataBase Reference)
Sicherheit und Regulatorisches
Sicherheitsdaten
- F
- 3-9-34
- wgk
- 3
- hs_code
- 2933.99.9701
- RTECS-Nr.
- XA5255700
- risk_code
- 36/37/38
- hazard_code
- Xi
- safety_code
- 26-36
- Speicherklasse
- 11 - Combustible Solids
- Hazard Classifications
- Eye Irrit. 2Skin Irrit. 2STOT SE 3
Chemie und Industrie
Anwendungen
Verwenden1,4,8,11-Tetramethyl-1,4,8,11-tetraazacyclotetradecane is used as a macrocyclic chelating agent in coordination chemistry. It is also used as a ligand which bind strongly to a wide range of metal ions and as crown ethers.
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