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| IUPAC name : | 3-(4-methyl-1-cyclohex-3-enyl)butan-1-ol |
| InChI : | InChI=1/C11H20O/c1-9-3-5-11(6-4-9)10(2)7-8-12/h3,10-12H,4-8H2,1-2H3 |
| InChIKey : | JTVKFAPEIBMMHX-UHFFFAOYAP |
| SMILES : | CC1=CCC(CC1)C(C)CCO |
| (EINECS) number : | 239-845-7 |
| cas number : | 15760-18-6 |
| molar refractivity : | 52.01 ± 0.3 cm3 |
| parachor : | 437.8 ± 6.0 cm3 |
| index of refraction : | 1.477 ± 0.02 |
| surface tension : | 32.1 ± 3.0 dyne/cm |
| density : | 0.915 ± 0.06 g/cm3 |
| polarizability : | 20.61 ± 0.5 10-24cm3 |
| xlogp : | 3.30 |
| molecular weight : | 168.2759000 |
| formula : | C11 H20 O |
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| export tariff code : | unspecified |
| fda reg : | unspecified |
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Suppliers :
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| Firmenich : | CYCLOMETHYLENE CITRONELLOL
≥98% |
organoleptics :
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| odor type : | floral |
| odor strength : | medium |
odor description : at 100.00 %. | fresh sweet clean citrus rose warm herbal |
| substantivity : | 198 hour(s) at 100.00 % |
properties :
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| appearence : | colorless clear liquid |
| assay : | 92.00 to 96.00 %
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| Food Chemicals Codex Listed : | No |
| specific gravity : | 0.93200 to 0.94200 @ 20.00 °C.
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| pounds per gallon - calc. : | 7.764 to 7.848
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| refractive index : | 1.48400 to 1.48800 @ 20.00 °C.
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| boiling point : | 95.00 °C. @ 1.00 mm Hg
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| acid value : | 1.00 max. KOH/g
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| logp : | 3.38 |
safety :
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| 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 citrus propanol usage levels up to : |
| | 5.0000 % in the fragrance concentrate.
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| recommendation for citrus propanol usage levels up to : |
| | not for flavor use.
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safety links :
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| (EINECS) number : | 239-845-7 |
| chemidplus : | 015760186 |
| EPA Substance Registry Services : | 15760-18-6 |
| NLM Chemical Carcinogenesis Research Information System : | 15760-18-6 |
| NLM Developmental and Reproductive Toxicity : | 15760-18-6 |
| NLM Env. Mutagen Info. Center : | 15760-18-6 |
| NLM GENetic TOXicology : | 15760-18-6 |
| EPI System : | view |
other :
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references :
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| pubchem : | 662772 |