Grundinformationen
- Standard-SMILES
CCC(CC)CO- InChIKey
TZYRSLHNPKPEFV-UHFFFAOYSA-N- Summenformel
- C6H14O
- Durchschnittliche Molmasse
- 102,17 g/mol
- Monoisotopische Masse
- 102,10446507
Überblick
Flash point of 137 °F. Less dense than water and slightly soluble in water. Vapors are heavier than air. Used as a solvent and in the manufacture of pharmaceuticals.
Namen und Bezeichner
- Bevorzugter Name
- 2-Ethyl-1-butanol
- IUPAC
- 2-ethylbutan-1-ol
- Englischer Name
- 2-Ethyl-1-butanol
- Summenformel
- C6H14O
- Molmasse
- 0
Namen und Synonyme
Weitere Namen anzeigen
Datenbank-Bezeichner
- CAS
97-95-0- PubChem CID
- 7358
- DTXSID
DTXSID2041416- ChEMBL
CHEMBL3181836- UNII
- 28002VFS3H
- EC Number
- 202-621-4
- Nikkaji
- J55.485E
Eigenschaften
Berechnete Struktureigenschaften
- XLogP
- 1,6
- Polarare Oberfläche (TPSA)
- 20,2 Ų
- H-Brücken-Donoren
- 1
- H-Brücken-Akzeptoren
- 1
- Frei drehbare Bindungen
- 3
- Schwere Atome
- 7
- Formalladung
- 0
- Komplexität
- 31,2
Experimentelle und physikochemische Eigenschaften
Density
0.834 at 68 °F (USCG, 1999) - Less dense than water; will float
0.8326 @ 20 °C/4 °C
Solubility
SLIGHTLY SOL IN WATER; SOL IN ALCOHOL, ETHER
MISCIBLE WITH MOST ORGANIC SOLVENTS
Flash Point
128 °F (USCG, 1999)
137 °F OC.
Boiling Point
293 °F at 760 mmHg (USCG, 1999)
146.27 °C @ 760 MM HG
Melting Point
-173 °F (USCG, 1999)
LESS THAN -15 °C
Physikochemische Eigenschaften
- Schmelzpunkt
- -15 °C · <-15 °C
- Siedepunkt
- 146.27 °C · 146.27 °C
- Dichte
- 0.8326 g/cm3 · 0.8326 g/cm3
- pka
- 15.05 · 15.05±0.10(Predicted)
Sicherheit und Regulatorisches
GHS-Klassifizierung
GHS Classification
Warning
H302: Harmful if swallowed [Warning Acute toxicity, oral]
P264, P270, P280, P301+P317, P302+P352, P317, P321, P330, P362+P364, and P501 (click each P-code to see the statement)
This chemical does not meet GHS hazard criteria for 2.6% (11 of 419) of reports.
Warning
H226 (34.8%): Flammable liquid and vapor [Warning Flammable liquids]
Gefahrenhinweise
Regulatory Information
Chemical: 1-Butanol, 2-ethyl-
1-Butanol, 2-ethyl- is listed on the EPA's Chemical Data Reporting (CDR) system. Manufacturers and importers of 1-Butanol, 2-ethyl- 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: 05-11-2020 https://echa.europa.eu/registration-dossier/-/registered-dossier/31751
Ethylbutanol: 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 129 [Flammable Liquids (Water-Miscible / Noxious)]:
· HIGHLY FLAMMABLE: Will be easily ignited by heat, sparks or flames.
Fire Potential
COMBUSTIBLE.
MODERATE, WHEN EXPOSED TO HEAT OR FLAME; CAN REACT WITH OXIDIZING MATERIALS.
Health Hazards
Liquid causes eye burns. Vapors may be mildly irritating to nose and throat. (USCG, 1999)
· May cause toxic effects if inhaled or absorbed through skin.
Hazards Summary
May burn eyes; A mild nose and throat irritant; [CAMEO] A nose and throat irritant; A severe eye irritant, based on animal studies; Inhalation of high concentrations can cause CNS depression; [CHEMINFO] An irritant; Can be absorbed through skin; [MSDSonline]
Reactivity Profile
Flammable and/or toxic gases are generated by the combination of alcohols, such as 2-ETHYLBUTANOL, with alkali metals, nitrides, and strong reducing agents. Alcohols react with oxoacids and carboxylic acids to form esters plus water. Oxidizing agents convert them to aldehydes or ketones. Alcohols exhibit both weak acid and weak base behavior. They may initiate the polymerization of isocyanates and epoxides.
DOT Emergency Guidelines
/GUIDE 129: FLAMMABLE LIQUIDS (POLAR/WATER-MISCIBLE/NOXIOUS)/ Fire or Explosion: HIGHLY FLAMMABLE: Will be easily ignited by heat, sparks or flames. Vapors may form explosive mixtures with air. Vapors may travel to source of ignition and flash back. Most vapors are heavier than air. They will spread along ground and collect in low confined areas (sewers, basements, tanks). Vapor explosion hazard indoors, outdoors or in sewers. Those substances designated with "P" may polymerize explosively when heated or involved in a fire. Runoff to sewer may create fire or explosion hazard. Containers may explode when heated. Many liquids are lighter than water.
/GUIDE 129: FLAMMABLE LIQUIDS (POLAR/WATER-MISCIBLE/NOXIOUS)/ Health: May cause toxic effects if inhaled or absorbed through skin. Inhalation or contact with material may irritate or burn skin and eyes. Fire will produce irritating, corrosive and/or toxic gases. Vapors may cause dizziness or suffocation. Runoff from fire control or dilution water may cause pollution.
/GUIDE 129: FLAMMABLE LIQUIDS (POLAR/WATER-MISCIBLE/NOXIOUS)/ Public Safety: CALL Emergency Response Telephone Number ... . As an immediate precautionary measure, isolate spill or leak area for at least 50 meters (150 feet) in all directions. Keep unauthorized personnel away. Stay upwind. Keep out of low areas. Ventilate closed spaces before entering.
/GUIDE 129: FLAMMABLE LIQUIDS (POLAR/WATER-MISCIBLE/NOXIOUS)/ Protective Clothing: Wear positive pressure self-contained breathing apparatus (SCBA). Structural firefighters' protective clothing will only provide limited protection.
For more DOT Emergency Guidelines (Complete) data for ETHYL BUTANOL (8 total), please visit the HSDB record page.
DOT Hazard Classification
2-Ethylbutanol
UN2275
Class 3 Flammable and combustible liquid (49 eCFR § 173.120)
PG III: the degree of danger presented by the material is minor
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
Remove to fresh air. Remove contaminated clothing. Wash affected skin areas with water. Flush eyes with water for at least 15 min. and get medical care. (USCG, 1999)
General First Aid:
Isolation and Evacuation
Excerpt from ERG Guide 129 [Flammable Liquids (Water-Miscible / Noxious)]:
Immediate precautionary measure
Toxikologische Informationen
Human Toxicity Excerpts
SUMMARY TOXICITY STATEMENT; ACUTE: MODERATE VIA ORAL, DERMAL & PROBABLY INHALATION ROUTES. MODERATE= MAY CAUSE REVERSIBLE OR IRREVERSIBLE CHANGES TO EXPOSED TISSUE, NOT PERMANENT INJURY OR DEATH; CAN CAUSE CONSIDERABLE DISCOMFORT.
LOW TOXICITY.
Non-Human Toxicity Excerpts
SKIN IRRITATION DEVELOPED IN RABBITS GIVEN CAPILLARY INJECTION OF 2-ETHYLBUTYL ALCOHOL. MODERATE SKIN IRRITATION DEVELOPED IN GUINEA PIGS. CONCN VAPOR INHALED BY RATS FOR 8 HR CAUSED NO DEATHS.
FROM RESULTS OF ANIMAL EXPT...2-ETHYL BUTANOL APPEARS TO BE MORE TOXIC BY ORAL ADMIN & SKIN ABSORPTION THAN METHYL AMYL ALCOHOL.
2-ETHYLBUTANOL-1 RATED 9 ON RABBIT EYES. ...TESTED EXTERNALLY ON EYES OF RABBITS &...RATED NUMERICALLY ON SCALE OF 1-10 ACCORDING TO DEGREE OF INJURY... AFTER 24 HR /OBSERVATION/, PAYING PARTICULAR ATTENTION TO CONDITION OF CORNEA. MOST SEVERE INJURIES HAVE BEEN RATED 10.
Sicherheitsdaten
- Alarmwort
- Warnung
- Gefahrenhinweise
- Code Gefahrenhinweise Gefahrenklasse Abteilung Alarmwort Symbol P-Code H226
Chemie und Industrie
Pharmakologische Informationen
Verwendung und Herstellung
Uses
Used as solvent for oils, resins, waxes, dyes, lacquers, and printing inks; to make perfumes, drugs, surface active agents, lubricants, and flavors; [HSDB] Used to make penetrating oils, corrosion inhibitors, plasticizers, and perfumes; as cleaning agent for printed circuits; and to improve flow of paints and varnishes; [CHEMINFO]
Painting (Solvents) [Category: Paint]
SOLVENT FOR OILS, RESINS, WAXES, DYES; DILUENT; SYN OF PERFUMES, DRUGS; FLAVORING
SOLVENT FOR PRINTING INKS; COMPONENT IN LACQUERS; MFR OF SURFACE ACTIVE AGENTS, SYNTHETIC LUBRICANTS, AND LUBRICANT ADDITIVES
U.S. Production
2022: <50,000 lb
(1984) 1.28X10+11 g/ALCOHOLS C11 OR LOWER/
Methods of Manufacturing
2-ETHYLBUTYL ALCOHOL CAN BE PREPARED COMMERCIALLY BY ALDOL CONDENSATION OF ACETALDEHYDE & BUTYRALDEHYDE.
PRODUCED INDUSTRIALLY BY THE CONDENSATION OF ACETALDEHYDE AND BUTYRALDEHYDE IN DILUTE CAUSTIC SOLUTION FOLLOWED BY HYDROGENATION OF THE ACROLEIN INTERMEDIATE
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