| Right Click Jmol Molecule For More Options. (Safari 1.2 (v125) Compatible). Jmol is a free download found Here. | ||||||||||||||||||||||||
| IUPAC name : | octahydro-5-methoxy-4,7-methano-1H-indene-2-carboxaldehyde | |||||||||||||||||||||||
| InChI : | InChI=1/C12H18O2/c1-14-12-5-8-4-11(12)10-3-7(6-13)2-9(8)10/h6-12H,2-5H2,1H3 | |||||||||||||||||||||||
| InChIKey : | UOGMZEGKCNHMBF-UHFFFAOYAA | |||||||||||||||||||||||
| SMILES : | COC1CC2CC1C3C2CC(C3)C=O | |||||||||||||||||||||||
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| export tariff code : | unspecified | |||||||||||||||||||||||
| fda reg : | unspecified | |||||||||||||||||||||||
Suppliers : | ||||||||||||||||||||||||
| Firmenich : | Scentenal®
≥96% Odor: Complex aldehyde marine note associated with a watery green floral character Its value is best appreciated in combination with other green notes, in chypres, eau de colognes, masculine notes and sheer floral types. It is an excellent modifier or enhancer of other ozone marine notes. | |||||||||||||||||||||||
| Vigon : | Scentenal
Odor: Complex aldehyde marine note associated with a watery green floral character | |||||||||||||||||||||||
organoleptics : | ||||||||||||||||||||||||
| odor type : | marine | |||||||||||||||||||||||
| odor strength : | medium | |||||||||||||||||||||||
| odor description: at 100.00 %. | fresh sea breeze watery floral ozone Luebke, William tgsc, (1985) | |||||||||||||||||||||||
| odor sample from : | Chem-Fleur, Inc. | |||||||||||||||||||||||
| substantivity : | 287 hour(s) at 100.00 % | |||||||||||||||||||||||
properties : | ||||||||||||||||||||||||
| appearence : | colorless clear viscous liquid | |||||||||||||||||||||||
| Food Chemicals Codex Listed : | No | |||||||||||||||||||||||
| specific gravity : | 1.07500 to 1.07900 @ 25.00 °C. | |||||||||||||||||||||||
| pounds per gallon - calc. : | 8.945 to 8.978 | |||||||||||||||||||||||
| refractive index : | 1.49900 to 1.50000 @ 20.00 °C. | |||||||||||||||||||||||
| boiling point : | 92.00 to 100.00 °C. @ 2.00 mm Hg | |||||||||||||||||||||||
| acid value : | 5.00 max. KOH/g | |||||||||||||||||||||||
| flash point : | > 212.00 °F. TCC ( > 100.00 °C. ) | |||||||||||||||||||||||
| logP (o/w) : | 1.33 | |||||||||||||||||||||||
safety : | ||||||||||||||||||||||||
| most important hazard(s) : | Xi - Irritant | |||||||||||||||||||||||
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R 36/38 - Irritating to skin and eyes. R 43 - May cause sensitisation by skin contact. 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 36/37/39 - Wear suitable clothing, gloves and eye/face protection. | ||||||||||||||||||||||||
| Oral Toxicity(LD50) : | ||||||||||||||||||||||||
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Oral-Rat 2800.00 mg/kg Food and Chemical Toxicology. Vol. 30, Pg. 77S, 1992. | ||||||||||||||||||||||||
| Dermal Toxicity(LD50) : | ||||||||||||||||||||||||
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Skin-Rabbit >2000.00 mg/kg Food and Chemical Toxicology. Vol. 30, Pg. 77S, 1992. | ||||||||||||||||||||||||
| Inhalation Toxicity(LC50) : | ||||||||||||||||||||||||
| Not determined | ||||||||||||||||||||||||
safety in use : | ||||||||||||||||||||||||
| Category : | fragrance agents | |||||||||||||||||||||||
| IFRA critical Effect : | Sensitization | |||||||||||||||||||||||
| IFRA fragrance material specification : | ||||||||||||||||||||||||
| Should not be used such that the level in finished cosmetic products exceeds 0.5%. Based on test results showing sensitisation potential (IFRA guidelines). | ||||||||||||||||||||||||
| Fragrance usage is IFRA RESTRICTED. View Standard for complete information. | ||||||||||||||||||||||||
| Please review all IFRA documents for complete information. (QRA) | ||||||||||||||||||||||||
| IFRA categories : limits in the finished product: (For a description of the categories, refer to the IFRA QRA Information Booklet.) | ||||||||||||||||||||||||
| Category 1 : See Note (1) | 0.10 % (1) | Category 2 : | 0.20 % | |||||||||||||||||||||
| Category 3 : | 0.50 % | Category 4 : | 0.50 % | |||||||||||||||||||||
| Category 5 : | 0.50 % | Category 6 : See Note (1) | 3.60 % (1) | |||||||||||||||||||||
| Category 7 : | 0.40 % | Category 8 : | 0.50 % | |||||||||||||||||||||
| Category 9 : | 0.50 % | Category 10 : | 0.50 % | |||||||||||||||||||||
| Category 11 : | See Note (2) | |||||||||||||||||||||||
| Notes : | ||||||||||||||||||||||||
For this material, for pragmatic reasons, restrictive levels allowed by the QRA for certain categories but actually being higher than those already in place before applying the QRA, will temporarily not be implemented until the end of a 5 year monitoring phase. At the end of the 5 years the position will be reevaluated again. | ||||||||||||||||||||||||
(1) IFRA would recommend that any material used to impart perfume or flavour in products intended for human ingestion should consist of ingredients that are in compliance with appropriate regulations for foods and food flavourings in the countries of planned distribution and, where these are lacking, with the recommendations laid down in the Code of Practice of IOFI (International Organisation of the Flavor Industry). Further information about IOFI can be found on its website (www.iofi.org). | ||||||||||||||||||||||||
(2) Category 11 includes all non-skin contact or incidental skin contact products. Due to the negligible skin contact from these types of products there is no justification for a restriction of the concentration of this fragrance ingredient in the finished product. | ||||||||||||||||||||||||
| recommendation for ocean carboxaldehyde flavor usage levels up to : | ||||||||||||||||||||||||
| not for flavor use. | ||||||||||||||||||||||||
safety references : | ||||||||||||||||||||||||
| EPI System : | view | |||||||||||||||||||||||
| IFRA : | view standard | |||||||||||||||||||||||
| Canada Domestic Sub. List : | Yes | |||||||||||||||||||||||
| EPA Chem. Sub. Inventory : | Yes | |||||||||||||||||||||||
| SCCNFP : | opinion | |||||||||||||||||||||||
| WGK Germany : | 2 | |||||||||||||||||||||||
octahydro-5-methoxy-4,7-methano-1H-indene-2-carboxaldehyde | ||||||||||||||||||||||||
| chemidplus : | 086803909 | |||||||||||||||||||||||
| EPA Substance Registry Services : | 86803-90-9 | |||||||||||||||||||||||
references : | ||||||||||||||||||||||||
octahydro-5-methoxy-4,7-methano-1H-indene-2-carboxaldehyde | ||||||||||||||||||||||||
| pubchem : | 740999 | |||||||||||||||||||||||
Cosmetics : | ||||||||||||||||||||||||
| Cosmetic uses : |
perfuming agents | |||||||||||||||||||||||
other : | ||||||||||||||||||||||||
| CosIng : | cosmetic data | |||||||||||||||||||||||