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| IUPAC name : | 3-cyclohexyl-2,2-dimethylpropan-1-ol |
| InChI : | InChI=1/C11H16O/c1-11(2,9-12)8-10-6-4-3-5-7-10/h3-7,12H,8-9H2,1-2H3 |
| InChIKey : | VNGAHMPMLRTSLF-UHFFFAOYAY |
| SMILES : | CC(C)(CC1=CC=CC=C1)CO |
| (EINECS) number : | 236-400-9 |
| cas number : | 13351-61-6 |
| molar refractivity : | 51.20 ± 0.3 cm3 |
| parachor : | 415.0 ± 4.0 cm3 |
| index of refraction : | 1.516 ± 0.02 |
| surface tension : | 36.1 ± 3.0 dyne/cm |
| density : | 0.969 ± 0.06 g/cm3 |
| polarizability : | 20.29 ± 0.5 10-24cm3 |
| xlogp : | 2.40 |
| molecular weight : | 164.2441400 |
| formula : | C11 H16 O |
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| export tariff code : | unspecified |
| fda reg : | unspecified |
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Suppliers :
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| Symrise : | Muguetalcohol
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organoleptics :
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| odor type : | floral |
| odor strength : | low |
odor description : at 100.00 %. | floral lily of the valley woody |
| substantivity : | 160 Hour(s) |
properties :
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| appearence : | colorless crystals |
| assay : | 96.00 to 100.00 %
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| Food Chemicals Codex Listed : | No |
| specific gravity : | 0.97200 to 9.82000 @ 25.00 °C.
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| pounds per gallon - calc. : | 8.088 to 81.712
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| refractive index : | 1.51450 to 1.52450 @ 20.00 °C.
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| melting point : | 34.00 to 35.00 °C. @ 760.00 mm Hg
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| logp : | 2.93 |
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 muguet propanol usage levels up to : |
| | 3.0000 % in the fragrance concentrate.
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| recommendation for muguet propanol 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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| | 3-cyclohexyl-2,2-dimethylpropan-1-ol
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| (EINECS) number : | 236-400-9 |
| chemidplus : | 013351616 |
| EPA Substance Registry Services : | 13351-61-6 |
| NLM Chemical Carcinogenesis Research Information System : | 13351-61-6 |
| NLM Developmental and Reproductive Toxicity : | 13351-61-6 |
| NLM Env. Mutagen Info. Center : | 13351-61-6 |
| NLM GENetic TOXicology : | 13351-61-6 |
references :
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| | 3-cyclohexyl-2,2-dimethylpropan-1-ol
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| pubchem : | 660289 |
| NIST Chemistry WebBook : | 2673018222 |
other :
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