Articles:
| Info: | Volatile Flavor Components in Bogyojosaeng and Suhong Cultivars of Strawberry (Fragaria ananassa Duch.) |
2-hexanone, 5-methyl-
Notes:
Volatile component in fruit pulp of papaya (Carica papaya), black tea aroma and in cooked beef and egg aroma
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Penta International Corporation Chemistry innovation At Penta, our products and services help businesses do business better. For over 30 years, Penta Manufacturing Company has played a growing role in worldwide chemistry innovations and applications. As an industry leader, Penta continues to pioneer chemistry-based solutions for practically every area of commerce. Our products and expertise have helped fuel technical advances in dozens of commercial applications including flavoring, coloring, fragrances and chemical processes. US Email: Technical Services US Email: Sales US Voice: (973) 740-2300 US Fax: (973) 740-1839 Product(s): 13-53175 METHYL ISOAMYL KETONE
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| CAS Number: | 110-12-3 |  3D/inchi
|
| ECHA EINECS - REACH Pre-Reg: | 203-737-8 | |
| FDA UNII: | 6O4A4A5F28 | |
| Nikkaji Web: | J36.968C | |
| Beilstein Number: | 0506163 | |
| MDL: | MFCD00008950 | |
| CoE Number: | 2144 | |
| XlogP3: | 1.90 (est) | |
| Molecular Weight: | 114.18778000 | |
| Formula: | C7 H14 O | |
| BioActivity Summary: | listing | |
| NMR Predictor: | Predict (works with chrome or firefox) | |
Category: herbicides / pesticides
US / EU / FDA / JECFA / FEMA / FLAVIS / Scholar / Patent Information:
| Google Scholar: | Search |
| Google Books: | Search |
| Google Scholar: with word "volatile" | Search |
| Google Scholar: with word "flavor" | Search |
| Google Scholar: with word "odor" | Search |
| Google Patents: | Search |
| US Patents: | Search |
| EU Patents: | Search |
| Pubchem Patents: | Search |
| PubMed: | Search |
| NCBI: | Search |
Physical Properties:
| Appearance: | colorless clear liquid (est) |
| Assay: | 96.00 to 100.00 % |
| Food Chemicals Codex Listed: | No |
| Specific Gravity: | 0.91300 @ 20.00 °C. |
| Refractive Index: | 1.40780 @ 20.00 °C. |
| Melting Point: | -74.00 °C. @ 760.00 mm Hg |
| Boiling Point: | 141.00 to 148.00 °C. @ 760.00 mm Hg |
| Vapor Pressure: | 5.197000 mmHg @ 25.00 °C. (est) |
| Vapor Density: | 3.94 ( Air = 1 ) |
| Flash Point: | 96.00 °F. TCC ( 36.00 °C. ) |
| logP (o/w): | 1.880 |
| Soluble in: | |
| alcohol | |
| water, 2611 mg/L @ 25 °C (est) | |
| water, 5400 mg/L @ 25 °C (exp) | |
Organoleptic Properties:
| Odor and/or flavor descriptions from others (if found). | |
Cosmetic Information:
| None found |
Suppliers:
| Eastman Chemical |
| MIAK
98.5 wt % min. |
| EMD Millipore |
| For experimental / research use only. |
| 5-Methyl-2-hexanone |
| Inoue Perfumery |
| isoAMYL METHYL KETONE |
| Penta International |
| METHYL ISOAMYL KETONE |
| Santa Cruz Biotechnology |
| For experimental / research use only. |
| 5-Methyl-2-hexanone |
| Sigma-Aldrich |
| For experimental / research use only. |
| 5-Methyl-2-hexanone 99% |
| Silver Fern Chemical |
| Methyl Isoamyl Ketone (MIAK)
Odor: characteristic Use: MIAK is used for applications such as industrial coatings, resin solvents, thinners, polymerization solvents, and rubber intermediates. |
| TCI AMERICA |
| For experimental / research use only. |
| Isoamyl Methyl Ketone >98.0%(GC) |
Safety Information:
| Preferred SDS: View | |
| European information : | |
| Most important hazard(s): | |
| Xn - Harmful. | |
|
R 10 - Flammable. R 20 - Harmful by inhalation. S 02 - Keep out of the reach of children. S 16 - Keep away from sources of ignition - No Smoking. S 23 - Do not breath vapour. S 24/25 - Avoid contact with skin and eyes. S 26 - In case of contact with eyes, rinse immediately with plenty of water and seek medical advice. S 37/39 - Wear suitable gloves and eye/face protection. | |
| Hazards identification | |
| Classification of the substance or mixture | |
| GHS Classification in accordance with 29 CFR 1910 (OSHA HCS) | |
| None found. | |
| GHS Label elements, including precautionary statements | |
| Pictogram | |
| Hazard statement(s) | |
| None found. | |
| Precautionary statement(s) | |
| None found. | |
| Oral/Parenteral Toxicity: | |
|
oral-rat LD50 3200 mg/kg LUNGS, THORAX, OR RESPIRATION: OTHER CHANGES CARDIAC: OTHER CHANGES National Technical Information Service. Vol. OTS0535379 oral-mouse LD50 2542 mg/kg Toxicology Letters. Vol. 30, Pg. 13, 1986. intraperitoneal-mouse LD50 800 mg/kg LUNGS, THORAX, OR RESPIRATION: OTHER CHANGES CARDIAC: OTHER CHANGES National Technical Information Service. Vol. OTS0535379 intraperitoneal-rat LDLo 400 mg/kg CARDIAC: OTHER CHANGES LUNGS, THORAX, OR RESPIRATION: OTHER CHANGES National Technical Information Service. Vol. OTS0535379 | |
| Dermal Toxicity: | |
|
skin-rabbit LD50 10 ml/kg Union Carbide Data Sheet. Vol. 8/7/1963 skin-guinea pig LD > 20 mL/kg LUNGS, THORAX, OR RESPIRATION: OTHER CHANGES CARDIAC: OTHER CHANGES National Technical Information Service. Vol. OTS0535379 | |
| Inhalation Toxicity: | |
|
inhalation-rat LC50 3813 ppm/6H LUNGS, THORAX, OR RESPIRATION: RESPIRATORY DEPRESSION CARDIAC: OTHER CHANGES LUNGS, THORAX, OR RESPIRATION: OTHER CHANGES National Technical Information Service. Vol. OTS0535379 | |
Safety in Use Information:
| Category: | herbicides / pesticides | ||
| Recommendation for 5-methyl-2-hexanone usage levels up to: | |||
| not for fragrance use. | |||
| Recommendation for 5-methyl-2-hexanone flavor usage levels up to: | |||
| not for flavor use. | |||
Safety References:
| EPI System: | View |
| NIOSH International Chemical Safety Cards: | search |
| NIOSH Pocket Guide: | search |
| AIDS Citations: | Search |
| Cancer Citations: | Search |
| Toxicology Citations: | Search |
| EPA Substance Registry Services (TSCA): | 110-12-3 |
| EPA ACToR: | Toxicology Data |
| EPA Substance Registry Services (SRS): | Registry |
| Laboratory Chemical Safety Summary : | 8034 |
| National Institute of Allergy and Infectious Diseases: | Data |
| WISER: | UN 2302 |
| WGK Germany: | 1 |
| 5-methylhexan-2-one | |
| Chemidplus: | 0000110123 |
| EPA/NOAA CAMEO: | hazardous materials |
| RTECS: | 110-12-3 |
References:
| 5-methylhexan-2-one | |
| NIST Chemistry WebBook: | Search Inchi |
| Canada Domestic Sub. List: | 110-12-3 |
| Pubchem (cid): | 8034 |
| Pubchem (sid): | 134974022 |
| Pherobase: | View |
Other Information:
| (IUPAC): | Atomic Weights of the Elements 2011 (pdf) |
| Videos: | The Periodic Table of Videos |
| tgsc: | Atomic Weights use for this web site |
| (IUPAC): | Periodic Table of the Elements |
| CHEMBL: | View |
| HMDB (The Human Metabolome Database): | HMDB31549 |
| FooDB: | FDB008160 |
| Export Tariff Code: | 2914.19.0000 |
| Typical G.C. | |
| VCF-Online: | VCF Volatile Compounds in Food |
| ChemSpider: | View |
| Formulations/Preparations: grade: 97.5% | |
Potential Blenders and core components note
| None Found | ||
Potential Uses:
| pennyroyal | FL/FR |
Occurrence (nature, food, other): note
| beef cooked beef Search PMC Picture | |
| egg Search PMC Picture | |
| papaya fruit Search Trop Picture | |
| patchouli oil china @ 0.01% Data GC Search Trop Picture | |
| strawberry fruit Search Trop Picture | |
| tea black tea Search Trop Picture |
Synonyms:
| iso | amyl methyl ketone |
| iso | butyl acetone |
| iso | butylacetone |
| 2- | hexanone, 5-methyl- |
| ketone, isopentyl methyl | |
| ketone, methyl isoamyl | |
| 5- | methyl hexan-2-one |
| methyl isoamyl ketone | |
| methyl isopentyl ketone | |
| 2- | methyl-5-hexanone |
| 5- | methyl-hexan-2-one |
| 5- | methylhexan-2-one |
| MIAK | |
| iso | pentyl methyl ketone |