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| IUPAC name : | 2-[(4R)-4,8-dimethylspiro[4.5]dec-8-en-1-yl]propan-2-ol |
| InChI : | InChI=1/C15H26O/c1-11-7-9-15(10-8-11)12(2)5-6-13(15)14(3,4)16/h7,12-13,16H,5-6,8-10H2,1-4H3/t12-,13u,15u/m1/s1 |
| InChIKey : | XDVDHFJMCJWDPI-DNOWBOINBY |
| SMILES : | C[C@@H]1CCC(C12CCC(=CC2)C)C(C)(C)O |
| cas number : | 28400-11-5 |
| molar refractivity : | 68.59 ± 0.4 cm3 |
| parachor : | 561.2 ± 6.0 cm3 |
| index of refraction : | 1.505 ± 0.03 |
| surface tension : | 34.7 ± 5.0 dyne/cm |
| density : | 0.96 ± 0.1 g/cm3 |
| polarizability : | 27.19 ± 0.5 10-24cm3 |
| XlogP : | 4.80 |
| XlogP3-AA : | 3.60 |
| molecular weight : | 222.3663400 (IUPAC) |
| formula : | C15 H26 O |
| NMR Predictor : | Predict |
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| export tariff code : | unspecified |
| fda reg : | unspecified |
organoleptics :
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properties :
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| assay : | 95.00 to 100.00 %
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| Food Chemicals Codex Listed : | No |
| boiling point : | 309.00 to 311.00 °C. @ 760.00 mm Hg
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| flash point : | 238.00 °F. TCC ( 114.44 °C. )
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| logP (o/w) : | 4.67 |
safety :
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| Oral Toxicity(LD50) : |
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Not determined
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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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| recommendation for beta-acorenol fragrance usage levels up to : |
| | not for fragrance use.
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| recommendation for beta-acorenol flavor 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-[(4R)-4,8-dimethylspiro[4.5]dec-8-en-1-yl]propan-2-ol |
| chemidplus : | 28400-11-5 |
| EPA Substance Registry Services : | 28400-11-5 |
references :
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| | 2-[(4R)-4,8-dimethylspiro[4.5]dec-8-en-1-yl]propan-2-ol |
| NIST Chemistry WebBook : | 28400115 |
| pubchem : | 39290806 |
other :
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| VCF-Online: | VCF Volatile Compounds in Food |