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| IUPAC name : | 5-methyl-2-propan-2-ylcyclohexan-1-ol |
| InChI : | InChI=1/C10H20O/c1-7(2)9-5-4-8(3)6-10(9)11/h7-11H,4-6H2,1-3H3 |
| InChIKey : | NOOLISFMXDJSKH-UHFFFAOYAE |
| SMILES : | CC1CCC(C(C1)O)C(C)C |
| cas number : | 89-78-1 |
| (EINECS) number : | 201-939-0 |
| beilstein number : | 3194263 |
| fema number : | 2665 |
| coe number : | 63 |
| jecfa number : | 427 |
| fl. number : | 02.015 |
| molar refractivity : | 47.83 ± 0.3 cm3 |
| parachor : | 409.8± 6.0 cm3 |
| index of refraction : | 1.457 ± 0.02 |
| surface tension : | 29.7 ± 3.0 dyne/cm |
| density : | 0.890 ± 0.06 g/cm3 |
| polarizability : | 18.96 ± 0.5 10-24cm3 |
| XlogP : | 3.20 |
| molecular weight : | 156.2652000 (IUPAC) |
| formula : | C10 H20 O |
| BioActivity Analysis : | 48416209 |
| NMR Predictor : | Predict |
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| export tariff code : | 2906.11.0000 |
| fda reg : | 172.515 182.20 |
Suppliers :
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| Fleurchem : | menthol, racemic USP
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| Moellhausen : | menthol L- synth.
99.7% min. nature identical kosher Odor: cool, peppermint Flavor: cold, sweet, mint |
| Moellhausen : | menthol L-
98% min. natural kosher Odor: cool, peppermint Flavor: cold, sweet, mint |
| Penta : | racemicmenthol
liquid |
| Polarome : | dextro,laevo-MENTHOL
SYNTHETIC USP/FCC |
| SAFC Global® : | DL-Menthol
FCC, Kosher Odor: minty; woody; camphoraceous |
| Symrise : | Menthol rac. PH
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| Symrise : | Menthol rac.
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| Takasago : | d,l-Menthol
≥98% as Menthol Odor: Mint-like odor with coolingness Used in perfumery to give power, lift, and freshness. For use in toothpaste, cough drops, mouthwash, ice cream, chewing gum, tobacco, medical plaster, tonic, and shampoos. |
| Vigon : | Menthol Crystals
Natural FCC |
| Vigon : | Menthol Liquid
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| Vigon : | Menthol Racemic
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organoleptics :
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| odor type : | mentholic |
| odor strength : | medium , recommend smelling in a 10.00 % solution or less |
odor description: at 10.00 % in dipropylene glycol. | peppermint cool woody |
| substantivity : | 32 Hour(s) |
properties :
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| appearence : | colorless crystalline fused |
| assay : | 99.00 to 100.00 %
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| Food Chemicals Codex Listed : | Yes |
| melting point : | 34.00 to 36.00 °C. @ 760.00 mm Hg
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| boiling point : | 212.00 to 216.00 °C. @ 760.00 mm Hg
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| vapor pressure : | 0.80000 mm/Hg @ 20.00 °C. |
| flash point : | 200.00 °F. TCC ( 93.33 °C. )
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| logP (o/w) : | 3.40 |
| shelf life : | 24.00 month(s) or longer if stored properly. |
| storage : | store in cool, dry place in tightly sealed containers, protected from heat and light. |
safety :
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| most important hazard(s) : | Xi - Irritant |
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R 37/38 - Irritating to respiratory system and skin. R 41 - Risk of serious damage to eyes. S 02 - Keep out of the reach of children. 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.
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| Oral Toxicity(LD50) : | |
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Gavage-Mouse [sex: M] 2652.00 mg/kg (Food & Drug Research LaboratoriesInc., 1975a)
Gavage-Mouse [sex: M] 4384.00 mg/kg (Food & Drug Research Laboratories Inc, 1975a)
Gavage-Mouse 3100.00 mg/kg (Wokes, 1932)
Gavage-Rat [sex: M,F] 3180.00 mg/kg (Jenner et al., 1964)
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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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| Category : | flavor and fragrance agents |
| Maximised Survey-derived Daily Intakes (MSDI-EU) : | 16000.00 (μg/capita/day) |
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| maximum skin levels for fine fragrances : |
| | 0.5200 % and are based on the assumption that the fragrance mixture is used at 20% in a consumer product (IFRA Use Level Survey). (IFRA, 2004)
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| recommendation for dextro,laevo-menthol fragrance usage levels up to : |
| | 8.0000 % in the fragrance concentrate.
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| use level in formulae for use in cosmetics : |
| | 0.2900 %
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| dermal systemic exposure in cosmetic products : |
| | 0.0074 mg/kg/day (IFRA, 2004)
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safety references :
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| European Food Safety Athority(efsa) : | Flavor usage levels; Subacute, Subchronic, Chronic and Carcinogenicity Studies; Developmental / Reproductive Toxicity Studies; Genotoxicity Studies... |
| msds : | msds |
| EPI System : | view |
| NLM Hazardous Substances Data Bank : | search |
| Chemical Carcinogenesis Research Information System : | Search |
| EPA GENetic TOXicology : | Search |
| NLM Developmental and Reproductive Toxicity : | Search |
| National Toxicology Program : | Search |
| Canada Domestic Sub. List : | Yes |
| EPA Chem. Sub. Inventory : | Yes |
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| WGK Germany : | 2 |
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| | 5-methyl-2-propan-2-ylcyclohexan-1-ol |
| (EINECS) number : | 201-939-0 |
| RTECS : | OT0350000 for cas# 89-78-1 |
| chemidplus : | 000089781 |
| EPA/NOAA CAMEO : | hazardous materials |
| EPA Substance Registry Services : | 89-78-1 |
references :
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| Leffingwell : | chirality |
| | 5-methyl-2-propan-2-ylcyclohexan-1-ol |
| fl. number : | 02.015 |
| jecfa number : | 427 |
| NIST Chemistry WebBook : | 137215040 |
| pubchem : | 150000 |
Cosmetics :
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| Cosmetic uses : |
perfuming agents
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other :
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| CosIng : | cosmetic data |
| | C of A |
| RIFM : | listed |
| FMA : | listed |
| FDA Everything Added to Food in the United States (EAFUS) | View |
| Household Products : | Search |