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| IUPAC name : | N-(5-methylheptan-3-ylidene)hydroxylamine |
| InChI : | InChI=1/C8H17NO/c1-4-7(3)6-8(5-2)9-10/h7,10H,4-6H2,1-3H3 |
| InChIKey : | CBVWMGCJNPPAAR-UHFFFAOYAI |
| SMILES : | CCC(C)CC(=NO)CC |
| cas number : | 22457-23-4 |
| (EINECS) number : | 245-010-8 |
| beilstein number : | 1923529 |
| molar refractivity : | 42.76 ± 0.5 cm3 |
| parachor : | 366.0 ± 8.0 cm3 |
| index of refraction : | 1.445 ± 0.05 |
| surface tension : | 27.0 ± 7.0 dyne/cm |
| density : | 0.89 ± 0.1 g/cm3 |
| polarizability : | 16.95 ± 0.5 10-24cm3 |
| XlogP : | 2.60 |
| molecular weight : | 143.2266800 (IUPAC) |
| formula : | C8 H17 O N |
| BioActivity Analysis : | 440233 |
| NMR Predictor : | Predict |
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| export tariff code : | unspecified |
| fda reg : | unspecified |
Suppliers :
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| Givaudan : | Stemone®
Odor: Green, Natural, Leafy, Fresh, Powerful |
| Moellhausen : | stemone
94% min. artifical kosher |
| Penta : | stemone
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| Vigon : | Methyl-5 3-Heptanone Oxime Stemone
Odor: STRONG, STEMMY-GREEN |
organoleptics :
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| odor type : | green |
| odor strength : | medium |
odor description :¹ at 100.00 %. | galbanum fig leaf green weedy cortex |
| odor sample from : | Givaudan Corporation |
| substantivity : | 16 Hour(s) |
properties :
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| appearence : | colorless to pale yellow clear liquid |
| assay : | 97.00 to 100.00 %
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| Food Chemicals Codex Listed : | No |
| specific gravity : | 0.88600 to 0.89100 @ 25.00 °C.
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| pounds per gallon - calc. : | 7.372 to 7.414
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| specific gravity : | 0.88500 to 0.89000 @ 25.00 °C.
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| pounds per gallon - calc. : | 7.364 to 7.406
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| refractive index : | 1.45000 to 1.45500 @ 20.00 °C.
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| flash point : | 203.00 °F. TCC ( 95.00 °C. )
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| logP (o/w) : | 2.59 |
safety :
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| most important hazard(s) : | Xi - Irritant |
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R 36/38 - Irritating to skin and eyes. S 02 - Keep out of the reach of children. S 24/25 - Avoid contact with skin and eyes. S 26 - In case of contact with eyes, rinse immediately with plenty of water and seek medical advice. S 36 - Wear suitable protective clothing.
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| Oral Toxicity(LD50) : |
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Oral-Rat 3800.00 mg/kg Food and Chemical Toxicology. Vol. 30, Pg. 87S, 1992.
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| Dermal Toxicity(LD50) : |
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Skin-Rabbit 5000.00 mg/kg Food and Chemical Toxicology. Vol. 30, Pg. 87S, 1992.
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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 leafy oxime usage levels up to : |
| | 5.0000 % in the fragrance concentrate.
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| recommendation for leafy oxime usage levels up to : |
| | not for flavor use.
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safety references :
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| EPI System : | view |
| Canada Domestic Sub. List : | Yes |
| EPA Chem. Sub. Inventory : | Yes |
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| WGK Germany : | 2 |
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| | N-(5-methylheptan-3-ylidene)hydroxylamine
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| (EINECS) number : | 245-010-8 |
| chemidplus : | 022457234 |
| EPA Substance Registry Services : | 22457-23-4 |
references :
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| | N-(5-methylheptan-3-ylidene)hydroxylamine
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| pubchem : | 667537 |
Cosmetics :
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| Cosmetic uses : |
masking agents
perfuming agents
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other :
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| reference : | Luebke, William tgsc, (1986)¹ |
| CosIng : | cosmetic data |