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ocean carboxaldehyde
General Material Information
| Preferred name | ocean carboxaldehyde |
| Trivial Name | Octahydro-5-methoxy-4,7-methano-1H-indene-2-carboxaldehyde |
| Short Description | scentenal (Firmenich) |
| Formula | C12 H18 O2 |
| CAS Number | 86803-90-9 |
| FDA UNII | AUK25Q8UTG |
| Nikkaji Number | J453.561H |
| NMR Predictor | External link |
| Synonyms |
|
US / EU / FDA / JECFA / FEMA / Scholar / Patents
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| Google Books | Start search |
| Google Patents | Start search |
| Perfumer & Flavorists | Start search |
| EU Patents | Start search |
| PubMeb | Start search |
| NCBI | Start search |
Other Information
| (IUPAC): | Atomic Weights of the Elements 2011 (pdf) |
| Videos: | The Periodic Table of Videos |
| tgsc: | Atomic Weights use for this web site |
| (IUPAC): | Periodic Table of the Elements |
| HMDB (The Human Metabolome Database): | Search |
| ChemSpider: | View |
Suppliers
PhysChem Properties
| Material listed in food chemical codex | No |
| Molecular weight | 194.27386474609 |
| Specific gravity | @ 25 °C |
| Pounds per Gallon | 8.945 to 8.978 |
| Refractive Index | 1.499 to 1.5 @ 20 °C |
| Boiling Point | 92 to 100°C @ 2 mm Hg |
| Acid Value | 5 max KOH/g |
| Vapor Pressure | 0.004 mmHg @ 25 °C |
| Flash Point TCC Value | 100 °C TCC |
| logP (o/w) | 1.894 est |
| Solubility | |
| alcohol | Yes |
| water, 219.8 mg/L @ 25 °C (est) | Yes |
| Stability | |
| APC: traces - 2% | Unspecified |
| detergent: traces - 1% | Unspecified |
| softener: traces - 1% | Unspecified |
| shampoo: traces - 1% | Unspecified |
| soap: traces - 2% | Unspecified |
| candle: traces - 2% | Unspecified |
| fine fragrances: traces - 0.5% | Unspecified |
| shower gel: traces - 1% | Unspecified |
Organoleptic Properties
| Odor Type: Marine | |
| fresh, seashore, watery, floral, ozone, aldehydic, woody, mossy, magnolia | |
| Odor strength | medium |
| Substantivity | 287 hour(s) at 100.00 % |
| Luebke, William tgsc, (1985) | At 100.00 %. fresh sea breeze watery floral ozone |
| 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. | Complex aldehyde marine note associated with a watery green floral character |
| “Odor:Complex aldehyde marine note associated with a watery green floral character and slight mossy undertones. Use: 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.“ This versatile product is stable in most media with typical usage levels below 0.5% in fine fragrance often mere traces though up to 2% might be used in soaps or candles. | Marine, green, seaweed, ozone, floral-magnolia |
| General comment | Fresh, marine, ozone with a subtle floral note of magnolia |
Potential Uses
Safety Information
Safety information
| European information : | |
| Most important hazard(s): | |
| Xi - Irritant | |
| 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. | |
| Hazards identification | |
| Classification of the substance or mixture | |
| GHS Classification in accordance with 29 CFR 1910 (OSHA HCS) | |
| None found. | |
| GHS Label elements, including precautionary statements | |
| Pictogram | |
| Hazard statement(s) | |
| None found. | |
| Precautionary statement(s) | |
| None found. | |
| Oral/Parenteral Toxicity: | |
| oral-rat LD50 2800 mg/kg Food and Chemical Toxicology. Vol. 30, Pg. 77S, 1992. | |
| Dermal Toxicity: | |
| skin-rabbit LD50 > 2000 mg/kg Food and Chemical Toxicology. Vol. 30, Pg. 77S, 1992. | |
| Inhalation Toxicity: | |
| Not determined | |
Safety in use information
| Category: | |||
| fragrance agents | |||
| RIFM Fragrance Material Safety Assessment: Search | |||
| IFRA Code of Practice Notification of the 49th Amendment to the IFRA Code of Practice | |||
| IFRA Critical Effect: | |||
| Dermal sensitization and systemic toxicity | |||
| 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). | |||
| View the IFRA Standard | |||
| View IFRA Standards Library for complete information. | |||
| Please review Amendment 49 IFRA documentation for complete information. | |||
| IFRA RESTRICTION LIMITS IN THE FINISHED PRODUCT (%): | |||
| Category 1: Products applied to the lips | |||
| 0.19 % | |||
| Category 2: Products applied to the axillae | |||
| 0.057 % | |||
| Category 3: Products applied to the face/body using fingertips | |||
| 1.20 % | |||
| Category 4: Products related to fine fragrance | |||
| 1.10 % | |||
| Category 5: Products applied to the face and body using the hands (palms), primarily leave-on | |||
| Category 5A: Body lotion products applied to the body using the hands (palms), primarily leave-on | |||
| 0.27 % | |||
| Category 5B: Face moisturizer products applied to the face using the hands (palms), primarily leave-on | |||
| 0.27 % | |||
| Category 5C: Hand cream products applied to the hands using the hands (palms), primarily leave-on | |||
| 0.27 % | |||
| Category 5D: Baby Creams, baby Oils and baby talc | |||
| 0.091 % | |||
| Category 6: Products with oral and lip exposure | |||
| 0.63 % | |||
| Category 7: Products applied to the hair with some hand contact | |||
| Category 7A: Rinse-off products applied to the hair with some hand contact | |||
| 2.20 % | |||
| Category 7B: Leave-on products applied to the hair with some hand contact | |||
| 2.20 % | |||
| Category 8: Products with significant anogenital exposure | |||
| 0.091 % | |||
| Category 9: Products with body and hand exposure, primarily rinse off | |||
| 2.10 % | |||
| Category 10: Household care products with mostly hand contact | |||
| Category 10A: Household care excluding aerosol products (excluding aerosol/spray products) | |||
| 2.10 % | |||
| Category 10B: Household aerosol/spray products | |||
| 7.50 % | |||
| Category 11: Products with intended skin contact but minimal transfer of fragrance to skin from inert substrate | |||
| Category 11A: Products with intended skin contact but minimal transfer of fragrance to skin from inert substrate without UV exposure | |||
| 0.091 % | |||
| Category 11B: Products with intended skin contact but minimal transfer of fragrance to skin from inert substrate with potential UV exposure | |||
| 0.091 % | |||
| Category 12: Products not intended for direct skin contact, minimal or insignificant transfer to skin | |||
| IFRA_STD_056.pdf | |||
| Notes: | |||
| IFRA FLAVOR REQUIREMENTS: | |||
Due to the possible ingestion of small amounts of fragrance ingredients from their use in products in Categories 1 and 6, materials must not only comply with IFRA Standards but must also be recognized as safe as a flavoring ingredient as defined by the IOFI Code of Practice (www.iofi.org). For more details see chapter 1 of the Guidance for the use of IFRA Standards. | |||
| Recommendation for ocean carboxaldehyde flavor usage levels up to: | |||
| not for flavor use. | |||
Safety references
| EPI System: View |
| AIDS Citations:Search |
| Cancer Citations:Search |
| Toxicology Citations:Search |
| EPA Substance Registry Services (TSCA):86803-90-9 |
| EPA ACToR:Toxicology Data |
| EPA Substance Registry Services (SRS):Registry |
| Laboratory Chemical Safety Summary :163529 |
| National Institute of Allergy and Infectious Diseases:Data |
| SCCNFP:opinion |
| WGK Germany:2 |
| octahydro-5-methoxy-4,7-methano-1H-indene-2-carboxaldehyde |
| Chemidplus:0086803909 |