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| Right Click Picture For More Options. (Safari 1.2 (v125) Compatible). |
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| IUPAC name : | 5-hexyl-5-methyloxolan-2-one |
| InChI : | InChI=1/C11H20O2/c1-3-4-5-6-8-11(2)9-7-10(12)13-11/h3-9H2,1-2H3 |
| InChIKey : | ALWUKGXLBSQSMA-UHFFFAOYAD |
| SMILES : | CCCCCCC1(CCC(=O)O1)C |
| (EINECS) number : | 230-291-1 |
| cas number : | 7011-83-8 |
| beilstein number : | 0123344 |
| fema number : | 3786 |
| jecfa number : | 250 |
| fl. number : | 10.051 |
| molar refractivity : | 52.65 ± 0.3 cm3 |
| parachor : | 462.8 ± 6.0 cm3 |
| index of refraction : | 1.443 ± 0.02 |
| surface tension : | 29.6 ± 3.0 dyne/cm |
| density : | 0.929 ± 0.06 g/cm3 |
| polarizability : | 20.87 ± 0.5 10-24cm3 |
| xlogp : | 3.70 |
| molecular weight : | 184.2753000 |
| formula : | C11 H20 O2 |
| BioActivity Analysis : | 427180 |
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| export tariff code : | 2932.29.6000 |
| fda reg : | unspecified |
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Suppliers :
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| Bedoukian Research : | gamma-METHYL DECALACTONE
≥96.0%, Kosher |
| Symrise : | Lactojasmone
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organoleptics :
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| odor type : | floral |
| odor strength : | medium |
odor description :¹ : at 100.00 %. | fresh waxy coconut jasmin natural |
| substantivity : | 192 Hour(s) |
properties :
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| appearence : | colorless clear liquid |
| assay : | 96.00 to 100.00 %
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| Food Chemicals Codex Listed : | No |
| specific gravity : | 0.93900 to 0.94600 @ 25.00 °C.
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| pounds per gallon - calc. : | 7.813 to 7.872
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| refractive index : | 1.44400 to 1.45300 @ 20.00 °C.
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| boiling point : | 135.00 °C. @ 0.50 mm Hg
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| logp : | 2.93 |
safety :
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| most important hazard(s) : |
Xi - Irritant |
| Oral Toxicity(LD50) : |
Oral-Rat >5000.00 mg/kg (Moreno, 1976j)
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| Dermal Toxicity(LD50) : |
Skin-Rabbit >5.00 gm/kg
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| Maximised Survey-derived Daily Intakes (MSDI-EU) : | ND (μg/capita/day) |
| flash point ( Deg. F. ) : | 230.00 °F. TCC ( 110.00 °C. )
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| recommendation for dihydrojasmone lactone usage levels up to : |
| | 1.0000 % in the fragrance concentrate.
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| recommendation for dihydrojasmone lactone usage levels up to : |
| | 10.0000 ppm in the flavor.
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safety links :
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| (EINECS) number : | 230-291-1 |
| chemidplus : | 007011838 |
| EPA Substance Registry Services : | 7011-83-8 |
| NLM Chemical Carcinogenesis Research Information System : | 7011-83-8 |
| NLM Developmental and Reproductive Toxicity : | 7011-83-8 |
| NLM Env. Mutagen Info. Center : | 7011-83-8 |
| NLM GENetic TOXicology : | 7011-83-8 |
| dtp/nci : | 141822 |
| EPI System : | view |
other :
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references :
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| jecfa number : | 250 |
| fl. number : | 10.051 |
| pubchem : | 166025 |
| reference : | Luebke, William tgsc, (1989)¹ |