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| IUPAC name : | 2-methyl-5-prop-1-en-2-ylcyclohex-2-en-1-one |
| InChI : | InChI=1/C10H14O/c1-7(2)9-5-4-8(3)10(11)6-9/h4,9H,1,5-6H2,2-3H3 |
| InChIKey : | ULDHMXUKGWMISQ-UHFFFAOYAB |
| SMILES : | CC1=CCC(CC1=O)C(=C)C |
| cas number : | 99-49-0 |
| (EINECS) number : | 202-759-5 |
| beilstein number : | 1364206 |
| fema number : | 2249 |
| coe number : | 146 |
| fl. number : | 07.012 |
| molar refractivity : | 45.48 ± 0.3 cm3 |
| parachor : | 373.3 ± 6.0 cm3 |
| index of refraction : | 1.481 ± 0.02 |
| surface tension : | 29.8 ± 3.0 dyne/cm |
| density : | 0.940 ± 0.06 g/cm3 |
| polarizability : | 18.03 ± 0.5 10-24cm3 |
| XlogP : | 1.70 |
| molecular weight : | 150.2175600 |
| formula : | C10 H14 O |
| BioActivity Analysis : | 72264 |
| NMR Predictor : | Predict |
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| export tariff code : | unspecified |
| fda reg : | 182.60 |
organoleptics :
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| odor strength : | medium |
odor description : at 100.00 %. | minty licorice |
properties :
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| appearence : | colorless to pale yellow clear liquid |
| assay : | 97.00 to 100.00 %
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| Food Chemicals Codex Listed : | No |
| boiling point : | 230.00 to 231.00 °C. @ 760.00 mm Hg
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| boiling point : | 137.00 to 138.00 °C. @ 50.00 mm Hg
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| vapor pressure : | 0.16000 mm/Hg @ 25.00 °C. |
| flash point : | 192.00 °F. TCC ( 88.89 °C. )
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| logP (o/w) : | 3.07 |
safety :
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| Oral Toxicity(LD50) : |
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Oral-Rat 1640.00 mg/kg
Oral-Guineapig 766.00 mg/kg
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| Dermal Toxicity(LD50) : |
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Subcutaneous-Mouse 2675.00 mg/kg
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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 carvone usage levels up to : |
| | 2.0000 % in the fragrance concentrate.
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safety references :
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| EPI System : | view |
| NLM Hazardous Substances Data Bank : | search |
| Cancer Citations : | Search |
| Toxicology Citations : | Search |
| Env. Mutagen Info. Center : | Search |
| Canada Domestic Sub. List : | Yes |
| EPA Chem. Sub. Inventory : | Yes |
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| | 2-methyl-5-prop-1-en-2-ylcyclohex-2-en-1-one
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| (EINECS) number : | 202-759-5 |
| chemidplus : | 000099490 |
| EPA Substance Registry Services : | 99-49-0 |
| dtp/nci : | 6275 |
references :
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| | 2-methyl-5-prop-1-en-2-ylcyclohex-2-en-1-one
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| fl. number : | 07.012 |
| NIST Chemistry WebBook : | 2942816988 |
| pubchem : | 150508 |
Cosmetics :
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| Cosmetic uses : |
masking agents
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other :
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| CosIng : | cosmetic data |
| VCF-Online: | VCF Volatile Compounds in Food |