Grundinformationen
- Standard-SMILES
C=COCC(C)C- InChIKey
OZCMOJQQLBXBKI-UHFFFAOYSA-N- Summenformel
- C6H12O
- Durchschnittliche Molmasse
- 100,16 g/mol
- Monoisotopische Masse
- 100,088815
Überblick
Vinyl isobutyl ether appears as a clear colorless liquid. May polymerize if contaminated or subjected to heat. If polymerization take place inside a container, the container may violently rupture. Vapors are heavier than air.
Namen und Bezeichner
- Bevorzugter Name
- Vinyl isobutyl ether
- IUPAC
- 1-ethenoxy-2-methylpropane
- Lokaler Name
- Isobutylvinylether
- Englischer Name
- Isobutyl vinyl ether
- Summenformel
- C6H12O
- Molmasse
- 100.16
Namen und Synonyme
Weitere Namen anzeigen
Datenbank-Bezeichner
- CAS
109-53-5- PubChem CID
- 7992
- DTXSID
DTXSID8029608- ChEMBL
CHEMBL3183612- UNII
- 8HQ2X2D0TM
- EC Number
- 203-678-8
- Nikkaji
- J48.642F
Eigenschaften
Berechnete Struktureigenschaften
- XLogP
- 2,2
- Polarare Oberfläche (TPSA)
- 9,2 Ų
- H-Brücken-Donoren
- 0
- H-Brücken-Akzeptoren
- 1
- Frei drehbare Bindungen
- 3
- Schwere Atome
- 7
- Formalladung
- 0
- Komplexität
- 48,1
Experimentelle und physikochemische Eigenschaften
Chemical Classes
Other Classes -> Ethers, Other
Flammable agents - 3rd degree
Physical Description
Vinyl isobutyl ether appears as a clear colorless liquid. May polymerize if contaminated or subjected to heat. If polymerization take place inside a container, the container may violently rupture. Vapors are heavier than air.
Liquid
Clear colorless liquid; [CAMEO]
Physikochemische Eigenschaften
- Schmelzpunkt
- -112 °C · -112 °C
- Siedepunkt
- 83 °C · 83 °C
- Dichte
- 0.769 · 0.769
- Dampfdichte
- 3.45 · 3.45 (vs air)
- Dampfdruck
- 68 mm · 68 mm Hg ( 20 °C)
- Brechungsindex
- 20 · n20/D 1.395(lit.)
- Flammpunkt
- 8 °F · 8 °F
- storage temp.
- Flammables area
- Aggregatzustand
- clear liquid
- Farbe
- Colorless to Almost colorless
- Wasserlöslichkeit
- 0.7 g/L · 0.7 g/L (25 ºC)
- BRN
- 1560159 · 1560159
- Henry's Law Constant
- 3.9 · 3.9×10-3 mol/(m3Pa) at 25℃, Raventos-Duran et al. (2010)
- Dielectric constant
- 3.34 · 3.3399999999999999
- InChI
- 1S/C6H12O/c1-4-7-5-6(2)3/h4,6H,1,5H2,2-3H3
- InChIKey
- OZCMOJQQLBXBKI-UHFFFAOYSA-N
- SMILES
- CC(C)COC=C
- LogP
- 3.07 at · 3.07 at 25℃
- CAS Datenbank
- 109 · 109-53-5(CAS DataBase Reference)
- NIST chemische Informationen
- Vinylisobutyl ether(109-53-5)
- EPA chemische Informationen
- 1 · Propane, 1-(ethenyloxy)-2-methyl- (109-53-5)
Sicherheit und Regulatorisches
GHS-Klassifizierung
GHS Classification
This chemical does not meet GHS hazard criteria for 3.8% (8 of 213) of reports.
Danger
H225 (96.2%): Highly Flammable liquid and vapor [Danger Flammable liquids]
P210, P233, P240, P241, P242, P243, P264, P264+P265, P273, P280, P302+P352, P303+P361+P353, P305+P351+P338, P321, P332+P317, P337+P317, P362+P364, P370+P378, P403+P235, and P501 (click each P-code to see the statement)
Aggregated GHS information provided per 213 reports by companies from 10 notifications to the ECHA C&L Inventory. Each notification may be associated with multiple companies.
Danger
Gefahrenhinweise
Regulatory Information
Chemical: Propane, 1-(ethenyloxy)-2-methyl-
Propane, 1-(ethenyloxy)-2-methyl- is listed on the EPA's Chemical Data Reporting (CDR) system. Manufacturers and importers of Propane, 1-(ethenyloxy)-2-methyl- 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: 31-03-2023 https://echa.europa.eu/registration-dossier/-/registered-dossier/2053
Propane, 1-(ethenyloxy)-2-methyl-: Does not have an individual approval but may be used under an appropriate group standard
The New Jersey Worker and Community Right to Know Act requires public and private employers to provide information about hazardous substances at their workplaces. (N.J.S.A. 34:5A-1 et. seq.)
Fire Hazards
Excerpt from ERG Guide 127 [Flammable Liquids (Water-Miscible); polymerization hazard]:
· HIGHLY FLAMMABLE: Will be easily ignited by heat, sparks or flames.
Health Hazards
Excerpt from ERG Guide 127 [Flammable Liquids (Water-Miscible); polymerization hazard]:
· Inhalation or contact with material may irritate or burn skin and eyes.
Hazards Summary
May polymerize; Forms explosive peroxides on exposure to air; [CAMEO] A skin, eye, nose, and throat irritant; [NJ-HSFS] May form explosive peroxides; An irritant; [Sigma-Aldrich MSDS] Vinyl isobutyl ether, stabilized (UN1304) has warning of explosive polymerization; [ERG 2016]
DOT Hazard Classification
Vinyl isobutyl ether, stabilized
UN1304
Class 3 Flammable and combustible liquid (49 eCFR § 173.120)
PG II: the degree of danger presented by the material is medium
Peroxide Forming Chemical
Isobutyl vinyl ether
B: Compounds that form peroxides on concentration (distillation/evaporation)
Kelly
Sicherheit und Schutzausrüstung
Accidental Release Measures
· CALL 911. Then call emergency response telephone number on shipping paper. If shipping paper not available or no answer, refer to appropriate telephone number listed on the inside back cover.
· ELIMINATE all ignition sources (no smoking, flares, sparks or flames) from immediate area.
First Aid
Excerpt from ERG Guide 127 [Flammable Liquids (Water-Miscible); polymerization hazard]:
General First Aid:
Exposure Control and Personal Protection
· Wear positive pressure self-contained breathing apparatus (SCBA).
20.0 [ppm]
Isolation and Evacuation
Excerpt from ERG Guide 127 [Flammable Liquids (Water-Miscible); polymerization hazard]:
Immediate precautionary measure
Toxikologische Informationen
Sicherheitsdaten
- F
- 9
- wgk
- 1
- tsca
- TSCA listed
- ridadr
- UN 1304 (VINYL ISOBUTYL ETHER, STABILIZED)
- hs_code
- 29091990
- RTECS-Nr.
- KO1300000
- risk_code
- 11-38-52/53
- Toxizität
- rabbit,LD50,skin,20mL/kg (20mL/kg),American Industrial Hygiene Association Journal. Vol. 23, Pg. 95, 1962.
- hazard_code
- F,Xi
- safety_code
- 16-23-24/25-33-37-61
- hazard_class
- 3
- packing_group
- II
- Speicherklasse
- 3 - Flammable liquids
- Hazard Classifications
- Aquatic Chronic 3Flam. Liq. 2Skin Irrit. 2
Chemie und Industrie
Verwendung und Herstellung
Uses
Used in adhesives, coatings, and lacquers, as a resin modifier, plasticizer, and to make other chemicals; [NJ-HSFS]
Painting (Pigments, Binders, and Biocides) [Category: Paint]
General Manufacturing Information
All Other Basic Organic Chemical Manufacturing
Propane, 1-(ethenyloxy)-2-methyl-: ACTIVE
Anwendungen
VerwendenIsobutyl vinyl ether is use in preparation method and formula of bulk polymerized Chloroether resin.
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