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| IUPAC name : | 2-tert-butyl-4-methylcyclohexan-1-ol |
| InChI : | InChI=1/C11H22O/c1-8-5-6-10(12)9(7-8)11(2,3)4/h8-10,12H,5-7H2,1-4H3 |
| InChIKey : | OOPHUQPRWUXYDI-UHFFFAOYAR |
| SMILES : | CC1CCC(C(C1)C(C)(C)C)O |
| (EINECS) number : | 266-815-0 |
| cas number : | 67634-11-1 |
| molar refractivity : | 52.16 ± 0.3 cm3 |
| parachor : | 448.2 ± 6.0 cm3 |
| index of refraction : | 1.462 ± 0.02 |
| surface tension : | 31.1 ± 3.0 dyne/cm |
| density : | 0.897 ± 0.06 g/cm3 |
| polarizability : | 20.67 ± 0.5 10-24cm3 |
| xlogp : | 3.80 |
| molecular weight : | 170.2917800 |
| formula : | C11 H22 O |
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| export tariff code : | unspecified |
| fda reg : | unspecified |
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organoleptics :
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| odor type : | earthy |
| odor strength : | medium , recommend smelling in a 10.00 % solution or less |
odor description : at 10.00 % in dipropylene glycol. | fresh minty earthy vetiver |
properties :
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| appearence : | white solid |
| assay : | 95.00 to 100.00 %
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| Food Chemicals Codex Listed : | No |
| melting point : | 30.00 °C. @ 760.00 mm Hg
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| logp : | 3.55 |
safety :
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| most important hazard(s) : |
Xi - Irritant |
| Oral Toxicity(LD50) : |
Not determined
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| Dermal Toxicity(LD50) : |
Not determined
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| flash point ( Deg. F. ) : | > 212.00 °F. TCC ( > 100.00 °C. )
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| recommendation for patchouli cyclohexanol usage levels up to : |
| | 1.0000 % in the fragrance concentrate.
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| recommendation for patchouli cyclohexanol usage levels up to : |
| | not for flavor use.
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safety references :
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| EPI System : | view |
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| | 2-tert-butyl-4-methylcyclohexan-1-ol
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| (EINECS) number : | 266-815-0 |
| chemidplus : | 067634111 |
| EPA Substance Registry Services : | 67634-11-1 |
| NLM Chemical Carcinogenesis Research Information System : | 67634-11-1 |
| NLM Developmental and Reproductive Toxicity : | 67634-11-1 |
| NLM Env. Mutagen Info. Center : | 67634-11-1 |
| NLM GENetic TOXicology : | 67634-11-1 |
references :
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| | 2-tert-butyl-4-methylcyclohexan-1-ol
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| pubchem : | 683965 |
other :
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