HuagongsheHuagongshe Chemistry Print Report · For research reference only
Vinyl isobutyl ether
VINYL ISOBUTYL ETHER · IVE · vinoflexmo400* · isobutoxyethene · Lutanol LR 8500 · Vinoflex MO 400 · isobutoxy-ethene · 1-Isobutoxyethene
Identifiers & Physical Properties
| CAS No. | 109-53-5 |
|---|---|
| Molecular formula | C6H12O |
| Average molar mass | 100.16 g/mol |
| Monoisotopic mass | 100.088815 g/mol |
| SMILES | C=COCC(C)C |
| InChIKey | OZCMOJQQLBXBKI-UHFFFAOYSA-N |
| PubChem CID | 7992 |
| ChEMBL | CHEMBL3183612 |
| EC No. | 203-678-8 |
| DTXSID | DTXSID8029608 |
Chemical & Physical Properties
| XLogP | 2.2 |
|---|---|
| Topological polar surface area | 9.2 |
| Hydrogen bond donors | 0 |
| Hydrogen bond acceptors | 1 |
| Rotatable bonds | 3 |
| Heavy atoms | 7 |
| Formal charge | 0 |
| Complexity | 48.1 |
| Chemical classes | Other Classes -> Ethers, OtherFlammable agents - 3rd degree |
| SpringerMaterials Properties | Boiling point |
| Flash point | 15 °F (NFPA, 2010)8 °F |
| Vapor pressure | 59.5 [mmHg]68 mm Hg ( 20 °C) |
| 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.Clear colorless liquid[CAMEO] |
| Melting point | -112 °C |
| Boiling point | 83 °C |
| Density | 0.769 |
| Vapor density | 3.45 (vs air) |
| Refractive index | n20/D 1.395(lit.) |
| Storage conditions | Flammables area |
| Physical state | clear liquid |
| Color | Colorless to Almost colorless |
| Solubility | 0.7 g/L (25 ºC) |
| BRN | 1560159 |
| Henry's law constant | 3.9×10-3 mol/(m3Pa) at 25℃, Raventos-Duran et al. (2010) |
| Dielectric constant | 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 (partition coefficient) | 3.07 at 25℃ |
| CAS DataBase Reference | 109-53-5(CAS DataBase Reference) |
| FDA UNII | 8HQ2X2D0TM |
| NIST Chemistry Reference | Vinylisobutyl ether(109-53-5) |
| EPA Substance Registry System | Propane, 1-(ethenyloxy)-2-methyl- (109-53-5) |
| UNSPSC Code | 12162002 |
| NACRES | NA.23 |
| GHS pictogram | GHS02,GHS07 |
| Signal word | Danger |
| GHS hazard statements | H315-H319-H225 |
| GHS precautionary statements | P501-P240-P210-P233-P243-P241-P242-P264-P280-P370+P378-P337+P313-P305+P351+P338-P362+P364-P303+P361+P353-P332+P313-P403+P235 |
| Personal protective equipment (PPE) | Eyeshields, Faceshields, Gloves, type ABEK (EN14387) respirator filter |
| Hazard symbols | F,Xi |
| Risk statements (R) | 11-38-52/53 |
| Safety statements (S) | 16-23-24/25-33-37-61 |
| UN transport number | UN 1304 (VINYL ISOBUTYL ETHER, STABILIZED) |
| Water hazard class (WGK) | 1 |
| RTECS number | KO1300000 |
| F | 9 |
| TSCA inventory status | TSCA listed |
| Hazard class | 3Aquatic Chronic 3Flam. Liq. 2Skin Irrit. 2 |
| Packing group | II |
| Customs code | 29091990 |
| Storage class | 3 - Flammable liquids |
| Toxicity | rabbit,LD50,skin,20mL/kg (20mL/kg),American Industrial Hygiene Association Journal. Vol. 23, Pg. 95, 1962. |
| REACH registrations | Active |
| Limited quantities | 1.0 L (0.3 gallon) (liquid) |
| Excepted quantities | Max Inner Pack (30g or 30ml) and Max Outer Pack (500g or 500ml) |
Safety & Regulations
| GHS classification | This chemical does not meet GHS hazard criteria for 3.8% (8 of 213) of reports.DangerH225 (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. |
|---|---|
| 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/2053Propane, 1-(ethenyloxy)-2-methyl-: Does not have an individual approval but may be used under an appropriate group standardThe 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.) |
| DOT label | Flammable Liquid |
| 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 polymerizeForms explosive peroxides on exposure to air[CAMEO] A skin, eye, nose, and throat irritant[NJ-HSFS] May form explosive peroxidesAn irritant[Sigma-Aldrich MSDS] Vinyl isobutyl ether, stabilized (UN1304) has warning of explosive polymerization |
Applications & Uses
Uses
Isobutyl vinyl ether is use in preparation method and formula of bulk polymerized Chloroether resin.
Uses
Polymer and copolymers used in surgical adhesives, coatings, and lacquers; modifier for alkyd and polystyrene resins; plasticizer for nitrocellulose and other plastics; chemical intermediate.
General Description
A clear colorless liquid. Flash point 15°F. 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.