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| CAS No.: | 589-38-8 |
|---|---|
| Name: | 3-Hexanone |
| Molecular Structure: | |
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|
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| Formula: | C6H12 O |
| Molecular Weight: | 100.161 |
| Synonyms: | 3-Oxohexane;Ethyl propyl ketone |
| EINECS: | 209-645-4 |
| Density: | 0.815 |
| Melting Point: | -55°C |
| Boiling Point: | 125.5 °C at 760 mmHg |
| Flash Point: | 23 ºC |
| Solubility: | slightly soluble in water; soluble in acetone; soluble in alcohol and ether in all proportions |
| Appearance: | colourless liquid |
| Hazard Symbols: |
 
|
| Risk Codes: | R11;R36/37/38 |
| Safety: | Moderately toxic by ingestion, skin contact, and subcutaneous routes. Mildly toxic by inhalation. A skin and eye irritant. Flammable liquid. A very dangerous fire hazard when exposed to heat or flame; can react vigorously with oxidizing materials. To fight fire, use foam, CO2, dry chemical. When heated to decomposition it emits acrid smoke and fumes. See also KETONES. |
| Transport Information: | UN 1224 |
| PSA: | 17.07000 |
| LogP: | 1.76560 |
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Chemistry
Molecular Formula: C6H12O
Molecular Weight: 100.16
EINECS: 209-645-4
Flash Point: 23 ºC
Melting Point: -55°C
Storage temp: Flammables area
Refractive index 1.399-1.401
CAS Registry Number: 589-38-8
Appearance: colourless liquid
Density: 0.815 g/mL at 25 °C(lit.)
Enthalpy of Vaporization: 35.36 kJ/mol
Boiling Point: 125.5 °C at 760 mmHg
Vapour Pressure: 12.1 mmHg at 25°C
Stability: Stable, but may form peroxides on prolonged storage. Flammable. Incompatible with oxidizing agents, reducing agents, strong bases.
Synonyms: 3-Hexanone ; FEMA 3290 ; Ethyl propyl ketone ; Ethyl n-propyl ketone ; 3-Hexanon ; 3-Oxohexane ; Aethylpropylketon ; Hexan-3-one
Following is the molecular structure of 3-Hexanone (CAS NO.589-38-8):
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Uses
3-Hexanone (CAS NO.589-38-8) is a food with spice.and mainly used for the preparation of wine and other fruit flavor and the meat flavor.
Production
Methods of production: 3-Hexanone (CAS NO.589-38-8) is from the 3 - hexanol in the oxidative phosphorylation of the presence of Ni-Zn catalyst for dehydrogenation derived. May also be 2 - ethyl-furan hydrogenation derived. Or by β-furan-propionic acid in the 250-300 ℃ through 5% Pt-C catalyst derived benefits.
Toxicity Data With Reference
| 1. | skn-rbt 500 mg/24H MLD | 85JCAE Prehled Prumyslove Toxikologie; Organicke Latky Marhold, J.,Prague, Czechoslovakia.: Avicenum,1986,284. | ||
| 2. | eye-rbt 500 mg/24H MLD | 85JCAE Prehled Prumyslove Toxikologie; Organicke Latky Marhold, J.,Prague, Czechoslovakia.: Avicenum,1986,284. | ||
| 3. | orl-rat LD50:3360 mg/kg | TXAPA9 Toxicology and Applied Pharmacology. 28 (1974),313. | ||
| 4. | ihl-rat LCLo:4000 ppm/4H | TXAPA9 Toxicology and Applied Pharmacology. 28 (1974),313. | ||
| 5. | skn-rbt LD50:3170 mg/kg | TXAPA9 Toxicology and Applied Pharmacology. 28 (1974),313. | ||
| 6. | scu-gpg LDLo:700 mg/kg | BDKS** Studien uber die Pharmakologie des Pinakolins und einiger seiner Derivate mit besonderer Berucksichtigung der Kreislaufwirkung, Lennart Bang Dissertation .(Pharmakologischen Abteilung des Karolinischen Instituts,Stockholm, Sweden.: 1934). |
Consensus Reports
Reported in EPA TSCA Inventory.
Safety Profile
Moderately toxic by ingestion, skin contact, and subcutaneous routes. Mildly toxic by inhalation. A skin and eye irritant. Flammable liquid. A very dangerous fire hazard when exposed to heat or flame; can react vigorously with oxidizing materials. To fight fire, use foam, CO2, dry chemical. When heated to decomposition it emits acrid smoke and fumes.
Safety Information of 3-Hexanone (CAS NO.589-38-8):
Hazard Codes: Xi, 
F
Risk Statements: 11-36/37/38-10
R11:Highly flammable.
R36/37/38: Irritating to eyes, respiratory system and skin.
R10: Flammable.
Safety Statements: 26-36-16-9-37/39
S26: In case of contact with eyes, rinse immediately with plenty of water and seek medical advice.
S36: Wear suitable protective clothing.
S16: Keep away from sources of ignition.
S9: Keep container in a well-ventilated place.
RIDADR: UN 1224 3/PG 3
WGK Germany: 3
RTECS: MP1575000
HazardClass: 3
PackingGroup: III
Standards and Recommendations
DOT Classification: 3; Label: Flammable Liquid