Grundinformationen
- Standard-SMILES
CC1(C)CC(=O)C(C)(C)O1- InChIKey
HWFLEGUPVIFSJN-UHFFFAOYSA-N- Summenformel
- C8H14O2
- Durchschnittliche Molmasse
- 142,2 g/mol
- Monoisotopische Masse
- 142,09937969
Namen und Bezeichner
- Bevorzugter Name
- 2,2,5,5-Tetramethyltetrahydro-3-ketofuran
- IUPAC
- 2,2,5,5-tetramethyloxolan-3-one
- Englischer Name
- 2,2,5,5-Tetramethyltetrahydrofuran-3-one
- Summenformel
- C8H14O2
- Molmasse
- 142.2
Namen und Synonyme
5455-94-7Dihydro-2,2,5,5-tetramethyl-3(2H)-furanone2,2,5,5-Tetramethyltetrahydro-3-ketofuran3(2H)-Furanone,dihydro-2,2,5,5-tetramethyl-DTXSID50202976NSC 5593RefChem:242922DTXCID80125467627-582-4HWFLEGUPVIFSJN-UHFFFAOYSA-N2,2,5,5-Tetramethyldihydrofuran-3(2H)-one2,2,5,5-Tetramethyltetrahydrofuran-3-One
Weitere Namen anzeigen
Dihydro-2,2,5,5-tetramethyl-3(2H)-furanone 98%3-Oxo-2,2,5,5-tetramethyltetrahydrofuran, 2,2,5,5-Tetramethyloxolan-3-one
2,2,5,5-tetramethyloxolan-3-oneMFCD000096143(2H)-Furanone, dihydro-2,2,5,5-tetramethyl-2,2,5,5-tetramethyl-tetrahydro-furan-3-one2,2,5,5-Tetramethyldihydro-3(2H)-furanone2,2,5,5-tetramethyldihydrofuran-3-one2,2,5,5-tetramethyl-dihydro-furan-3-oneDihydro-2,2,5,5-tetramethyl-3(2H)furanone
Datenbank-Bezeichner
- CAS
5455-94-7- PubChem CID
- 138511
- DTXSID
DTXSID50202976- EC Number
- 627-582-4
- Nikkaji
- J81.037A
Eigenschaften
Berechnete Struktureigenschaften
- XLogP
- 0,8
- Polarare Oberfläche (TPSA)
- 26,3 Ų
- H-Brücken-Donoren
- 0
- H-Brücken-Akzeptoren
- 2
- Frei drehbare Bindungen
- 0
- Schwere Atome
- 10
- Formalladung
- 0
- Komplexität
- 168
Physikochemische Eigenschaften
- Siedepunkt
- 42 · 42-43 °C11 mm Hg(lit.)
- Dichte
- 0.926 g/mL · 0.926 g/mL at 25 °C(lit.)
- Brechungsindex
- 20 · n20/D 1.42(lit.)
- Flammpunkt
- 103 °F · 103 °F
- storage temp.
- 2 · 2-8°C
- Löslichkeit
- soluble in Chloroform, Ethyl Acetate
- Aggregatzustand
- Oil
- Farbe
- Clear Colorless
- InChI
- InChI=1S/C8H14O2/c1-7(2)5-6(9)8(3,4)10-7/h5H2,1-4H3
- InChIKey
- HWFLEGUPVIFSJN-UHFFFAOYSA-N
- SMILES
- O1C(C)(C)CC(=O)C1(C)C
Sicherheit und Regulatorisches
GHS-Klassifizierung
GHS Classification
Warning
H226 (100%): Flammable liquid and vapor [Warning Flammable liquids]
P210, P233, P240, P241, P242, P243, P280, P303+P361+P353, P370+P378, P403+P235, and P501 (click each P-code to see the statement)
Aggregated GHS information provided per 40 reports by companies from 1 notifications to the ECHA C&L Inventory.
Gefahrenhinweise
Hazard Classes and CategoriesFlam. Liq. 3 (100%)
Sicherheitsdaten
- wgk
- 3
- ridadr
- UN 1224 3/PG 3
- hs_code
- 29321900
- risk_code
- 10
- safety_code
- 16-24/25
- hazard_class
- 3.2
- packing_group
- III
- Speicherklasse
- 3 - Flammable liquids
- Hazard Classifications
- Flam. Liq. 3
Chemie und Industrie
Anwendungen
VerwendenDihydro-2,2,5,5-tetramethyl-3(2H)-furanone may be used in chemical synthesis.
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