Preferred name | (E,E)-pomarose |
Trivial Name | (2E,5E)-5,6,7-Trimethyl-2,5-octadien-4-one |
Short Description | 2,5-octadien-4-one, 5,6,7-trimethyl-, (2E,5E)- |
Formula | C11 H18 O |
CAS Number | 847144-75-6 |
FDA UNII | Search |
Nikkaji Number | J1.589.124F |
xLogP3-AA | 3.40 (est) |
NMR Predictor | External link |
Synonyms |
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Google Scholar | Start search |
Google Books | Start search |
Google Patents | Start search |
Perfumer & Flavorists | Start search |
EU Patents | Start search |
PubMeb | Start search |
NCBI | Start search |
(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 |
Material listed in food chemical codex | No |
Molecular weight | 166.26365661621 |
Vapor Pressure | 0.048 mmHg @ 25 °C |
Flash Point TCC Value | 89.4 °C TCC |
logP (o/w) | 2.683 est |
Solubility | |
water, 54.88 mg/L @ 25 °C (est) | Yes |
Odor Type: Fruity | |
fruity, rose, apple dried apple, plum, raisin, fruit dried fruit, rummy, caramellic | |
General comment | At 100.00 %. fruity rose dried apples plums raisins dried fruit rum caramel |
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: | |
Not determined | |
Dermal Toxicity: | |
Not determined | |
Inhalation Toxicity: | |
Not determined |
Category: | |||
fragrance agents | |||
RIFM Fragrance Material Safety Assessment: Search | |||
IFRA Code of Practice Notification of the 49th Amendment to the IFRA Code of Practice | |||
Recommendation for (E,E)-pomarose flavor usage levels up to: | |||
not for flavor use. |
EPI System: View |
EPA Substance Registry Services (TSCA):847144-75-6 |
EPA ACToR:Toxicology Data |
EPA Substance Registry Services (SRS):Registry |
Laboratory Chemical Safety Summary :15511119 |
National Institute of Allergy and Infectious Diseases:Data |
(2E,5E)-5,6,7-trimethylocta-2,5-dien-4-one |
Chemidplus:0847144756 |