2-Heptanol
Synonym(s):2-Heptanol;Methyl pentyl carbinol;Methyl pentyl carbinol, Methyl amyl carbinol
- CAS NO.:543-49-7
- Empirical Formula: C7H16O
- Molecular Weight: 116.2
- MDL number: MFCD00004587
- EINECS: 208-844-3
- SAFETY DATA SHEET (SDS)
- Update Date: 2024-11-20 11:41:24
What is 2-Heptanol?
Description
2-Heptanol has a brassy, herbaceous odor reminiscent of lemon and a fruity, green, somewhat bitter taste. 2-Heptanol may be synthesized from amyl magnesium bromide and acetaldehyde; by reduction of amyl methyl ketone with sodium metal in alcohol; by the action of Penicillium palitans on peanut oil.
Chemical properties
colourless liquid
Chemical properties
2-Heptanol has a brassy, herbaceous odor reminiscent of lemon and a fruity, green, somewhat bitter taste.
Occurrence
Reported found in apple, banana, berries, grapes, strawberry jam, coconut, coconut milk, cooked potato, clove bud, ginger, cheeses, fried beef, chicken fat, cognac, beer, hop oil, brandy, rum, grape wines, cocoa, coffee, tea, flberts, honey, soy- beans, Arctic bramble, passion fruit and juices, beans, mushrooms, calamus, buckwheat, sweet corn, malt, curcuma, mastic gum leaf oil and other sources
The Uses of 2-Heptanol
2-Heptanol may be used as an analytical standard for the determination of the analyte in volatile compound mixtures, fruit samples and aqueous samples by various chromatography techniques.
The Uses of 2-Heptanol
Solvent for synthetic resins, frothing agent in ore flotation.
Preparation
From amyl magnesium bromide and acetaldehyde; by reduction of amyl methyl ketone with sodium metal alcohol; by the action of Penicillium palitans on peanut oil.
Definition
ChEBI: 2-heptanol is an aliphatic alcohol.
Aroma threshold values
Detection: 41 ppb to 81 ppb.
Synthesis Reference(s)
Journal of the American Chemical Society, 89, p. 1522, 1967 DOI: 10.1021/ja00982a043
The Journal of Organic Chemistry, 43, p. 4255, 1978 DOI: 10.1021/jo00415a065
General Description
A clear colorless alcohol with a mild alcohol odor. Density approximately 6.8 lb / gal and insoluble in water. Hence floats on water. Flash point 130°F. Soluble in most organic liquids. Boiling point 320.7°F. Moderately toxic. Used as a solvent for various resins and as a flotation agent for ore processing.
Air & Water Reactions
Flammable. Insoluble in water.
Reactivity Profile
METHYLAMYL CARBINOL is an alcohol. Flammable and/or toxic gases are generated by the combination of alcohols with alkali metals, nitrides, and strong reducing agents. They 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.
Hazard
Moderate fire risk.
Health Hazard
Inhalation or contact with material may irritate or burn skin and eyes. Fire may produce irritating, corrosive and/or toxic gases. Vapors may cause dizziness or suffocation. Runoff from fire control or dilution water may cause pollution.
Properties of 2-Heptanol
Melting point: | -30.15°C |
Boiling point: | 160-162 °C (lit.) |
Density | 0.817 g/mL at 25 °C (lit.) |
vapor pressure | 1.6 hPa (25 °C) |
FEMA | 3288 | 2-HEPTANOL |
refractive index | n |
Flash point: | 140 °F |
storage temp. | Store below +30°C. |
solubility | 3.27g/l |
form | Liquid |
pka | 15.44±0.20(Predicted) |
Specific Gravity | 0.82 |
color | Clear colorless |
Odor | at 100.00 %. fresh lemon grass herbal sweet floral fruity green |
explosive limit | 0.9%(V) |
Water Solubility | 0.35 g/100 mL |
Merck | 14,4662 |
JECFA Number | 284 |
BRN | 1719088 |
Dielectric constant | 9.2100000000000009 |
Stability: | Stable. Flammable. Incompatible with strong oxidizing agents, strong acids. |
CAS DataBase Reference | 543-49-7(CAS DataBase Reference) |
NIST Chemistry Reference | 2-Heptanol(543-49-7) |
EPA Substance Registry System | 2-Heptanol (543-49-7) |
Safety information for 2-Heptanol
Signal word | Warning |
Pictogram(s) |
Flame Flammables GHS02 Exclamation Mark Irritant GHS07 |
GHS Hazard Statements |
H226:Flammable liquids H312:Acute toxicity,dermal H319:Serious eye damage/eye irritation |
Precautionary Statement Codes |
P210:Keep away from heat/sparks/open flames/hot surfaces. — No smoking. P280:Wear protective gloves/protective clothing/eye protection/face protection. P305+P351+P338:IF IN EYES: Rinse cautiously with water for several minutes. Remove contact lenses, if present and easy to do. Continuerinsing. |
Computed Descriptors for 2-Heptanol
InChIKey | CETWDUZRCINIHU-UHFFFAOYSA-N |
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