Grundinformationen
- Standard-SMILES
CCCCOCOCCCC- InChIKey
QLCJOAMJPCOIDI-UHFFFAOYSA-N- Summenformel
- C9H20O2
- Durchschnittliche Molmasse
- 160,25 g/mol
- Monoisotopische Masse
- 160,14632988
Namen und Bezeichner
- Bevorzugter Name
- Dibutoxymethane
- IUPAC
- 1-(butoxymethoxy)butane
- Lokaler Name
- 1,1'-[Methylenbis(oxy)]dibutan
- Englischer Name
- Dibutoxymethane
- Summenformel
- C9H20O2
- Molmasse
- 160.25
Namen und Synonyme
Weitere Namen anzeigen
Datenbank-Bezeichner
- CAS
2568-90-3- PubChem CID
- 17379
- DTXSID
DTXSID3062528- UNII
- V5WWR58LDU
- EC Number
- 219-909-0
- Nikkaji
- J112.977E
Eigenschaften
Berechnete Struktureigenschaften
- XLogP
- 3,2
- Polarare Oberfläche (TPSA)
- 18,5 Ų
- H-Brücken-Donoren
- 0
- H-Brücken-Akzeptoren
- 2
- Frei drehbare Bindungen
- 8
- Schwere Atome
- 11
- Formalladung
- 0
- Komplexität
- 56,6
Experimentelle und physikochemische Eigenschaften
Physikochemische Eigenschaften
- Schmelzpunkt
- -58.1 °C · -58.1°C
- Siedepunkt
- 180 °C · 180°C
- Dichte
- 0 · 0,84 g/cm3
- Dampfdruck
- 1 · 1-1.11hPa at 22.7-25℃
- Brechungsindex
- 20 · n20/D1.406
- Flammpunkt
- 60 °C · 60°C
- Aggregatzustand
- clear liquid
- Farbe
- Colorless to Almost colorless
- Wasserlöslichkeit
- 222.5 · 222.5-250mg/L at 20℃
- Kosmetik-Inhaltsstoffe Funktionen
- SURFACTANT - EMULSIFYINGCLEANSINGSOLVENT
- InChI
- 1S/C9H20O2/c1-3-5-7-10-9-11-8-6-4-2/h3-9H2,1-2H3
- InChIKey
- QLCJOAMJPCOIDI-UHFFFAOYSA-N
- SMILES
- CCCCOCOCCCC
- LogP
- 2.77 · 2.77-4.1 at 20-21.5℃
- EPA chemische Informationen
- 1 · Butane, 1,1'-[methylenebis(oxy)]bis- (2568-90-3)
Sicherheit und Regulatorisches
GHS-Klassifizierung
GHS Classification
This chemical does not meet GHS hazard criteria for 0.7% (1 of 143) of reports.
Warning
H226 (99.3%): Flammable liquid and vapor [Warning Flammable liquids]
P210, P233, P240, P241, P242, P243, P264, P273, P280, P302+P352, P303+P361+P353, P321, P332+P317, P362+P364, P370+P378, P403+P235, and P501 (click each P-code to see the statement)
Aggregated GHS information provided per 143 reports by companies from 5 notifications to the ECHA C&L Inventory. Each notification may be associated with multiple companies.
Gefahrenhinweise
Regulatory Information
Chemical: Butane, 1,1'-[methylenebis(oxy)]bis-
Butane, 1,1'-[methylenebis(oxy)]bis- is listed on the EPA's Chemical Data Reporting (CDR) system. Manufacturers and importers of Butane, 1,1'-[methylenebis(oxy)]bis- 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: 17-03-2022 https://echa.europa.eu/registration-dossier/-/registered-dossier/11620
Butylal: Does not have an individual approval but may be used under an appropriate group standard
Sicherheitsdaten
- wgk
- 1
- tsca
- TSCA listed
- ridadr
- 3271
- hs_code
- 2911.00.5000
- risk_code
- 36/37/38
- safety_code
- 26-36/37/39
- hazard_class
- 3
- packing_group
- III
- Speicherklasse
- 10 - Combustible liquids
Chemie und Industrie
Verwendung und Herstellung
Anwendungen
VerwendenFormaldehyde dibutyl acetal is a halogen-free and less toxic solvent that can be used to solubilize commercial low-density polyethylene (LDPE) samples to analyze molecular weight distribution using gel permeation chromatography (GPC). It can also be used as a reactant to prepare butoxymethyltriphenylphosphonium iodide, which is used for carbon homologation and also as a useful key intermediate in organic synthesis.
Darstellung
synthetischeA flask containing 15 gm (0.5 mole) of paraformaldehyde, 74 gm (1.0 mole) of η-butyl alcohol, and 2.0 gm of anhydrous ferric chloride is refluxed for 10 hr. The lower layer of 3-4 ml of material is discarded and then 50 ml of 10% aqueous sodium carbonate solution is added to remove the ferric chloride as ferric hydroxide. The product is shaken with a mixture of 40 ml of 20% hydrogen peroxide and 5 ml of 10% sodium carbonate solution at 45°C in order to remove any remaining aldehyde. The product is also washed with water, dried, and distilled from excess sodium metal to afford 62 gm (78%).
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