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| IUPAC name : | 2-methyl-5-propan-2-ylcyclohexan-1-one |
| InChI : | InChI=1/C10H18O/c1-7(2)9-5-4-8(3)10(11)6-9/h7-9H,4-6H2,1-3H3 |
| InChIKey : | GCRTVIUGJCJVDD-UHFFFAOYAJ |
| SMILES : | CC1CCC(CC1=O)C(C)C |
| cas number : | 59471-80-6 |
| fema number : | 3176 |
| molar refractivity : | 46.37 ± 0.3 cm3 |
| parachor : | 400.0 ± 6.0 cm3 |
| index of refraction : | 1.442 ± 0.02 |
| surface tension : | 27.2 ± 3.0 dyne/cm |
| density : | 0.881 ± 0.06 g/cm3 |
| polarizability : | 18.38 ± 0.5 10-24cm3 |
| XlogP : | 2.80 |
| molecular weight : | 154.2493200 |
| formula : | C10 H18 O |
| NMR Predictor : | Predict |
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| export tariff code : | 2914.29.0000 |
| fda reg : | unspecified |
Suppliers :
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| Bedoukian Research : | TETRAHYDROCARVONE
≥98.0% (sum of isomers), Kosher Odor: A mintier odor than l-carvone |
| Penta : | tetrahydrocarvone
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| Symrise : | Carvomenthone
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organoleptics :
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| odor type : | minty |
| odor strength : | medium |
odor description : at 100.00 %. | spearmint herbal |
properties :
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| appearence : | colorless clear liquid |
| assay : | 96.00 to 100.00 % sum of isomers
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| Food Chemicals Codex Listed : | No |
| specific gravity : | 0.89900 to 0.90300 @ 25.00 °C.
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| pounds per gallon - calc. : | 7.481 to 7.514
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| refractive index : | 1.45200 to 1.45500 @ 20.00 °C.
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| boiling point : | 108.00 to 109.00 °C. @ 760.00 mm Hg
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| vapor pressure : | 0.11600 mm/Hg @ 25.00 °C. |
| flash point : | 180.00 °F. TCC ( 82.22 °C. )
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| logP (o/w) : | 2.63 |
safety :
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| Oral Toxicity(LD50) : |
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Oral-Rat >2000.00 mg/kg
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| Dermal Toxicity(LD50) : |
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Not determined
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| Inhalation Toxicity(LC50) : |
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Not determined
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safety in use :
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| recommendation for tetrahydrocarvone usage levels up to : |
| | 3.0000 % in the fragrance concentrate.
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safety references :
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| EPI System : | view |
| Canada Domestic Sub. List : | Yes |
| EPA Chem. Sub. Inventory : | Yes |
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| | 2-methyl-5-propan-2-ylcyclohexan-1-one
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| chemidplus : | 059471806 |
| EPA Substance Registry Services : | 59471-80-6 |
| dtp/nci : | 96750 |
references :
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| | 2-methyl-5-propan-2-ylcyclohexan-1-one
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| NIST Chemistry WebBook : | 2759630896 |
| pubchem : | 675558 |
other :
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| VCF-Online: | VCF Volatile Compounds in Food |