Articles:
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butyraldehyde, 3-ethoxy-, diethyl acetal (8CI)
Notes:
None found
| CAS Number: | 5870-82-6 |  3D/inchi
|
| FDA UNII: | 25252SEX1K | |
| Nikkaji Web: | J42.087E | |
| Beilstein Number: | 1744486 | |
| MDL: | MFCD00026931 | |
| XlogP3-AA: | 1.80 (est) | |
| Molecular Weight: | 190.28294000 | |
| Formula: | C10 H22 O3 | |
| NMR Predictor: | Predict (works with chrome or firefox) | |
Category: natural substances and extractives
US / EU / FDA / JECFA / FEMA / FLAVIS / Scholar / Patent Information:
| Google Scholar: | Search |
| Google Books: | Search |
| Google Scholar: with word "volatile" | Search |
| Google Scholar: with word "flavor" | Search |
| Google Scholar: with word "odor" | Search |
| Google Patents: | Search |
| US Patents: | Search |
| EU Patents: | Search |
| Pubchem Patents: | Search |
| PubMed: | Search |
| NCBI: | Search |
Physical Properties:
| Appearance: | colorless to pale yellow clear liquid (est) |
| Food Chemicals Codex Listed: | No |
| Boiling Point: | 225.00 to 226.00 °C. @ 760.00 mm Hg (est) |
| Vapor Pressure: | 0.129000 mmHg @ 25.00 °C. (est) |
| Flash Point: | 175.00 °F. TCC ( 79.60 °C. ) (est) |
| logP (o/w): | 1.963 (est) |
| Soluble in: | |
| alcohol | |
| water, 1317 mg/L @ 25 °C (est) | |
| Insoluble in: | |
| water | |
| Stability: | |
| alkalis | |
Organoleptic Properties:
| Odor and/or flavor descriptions from others (if found). | |
Cosmetic Information:
| None found |
Suppliers:
| Sigma-Aldrich: Aldrich |
| For experimental / research use only. |
| 1,1,3-Triethoxybutane |
Safety Information:
| Preferred SDS: View | |
| 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 4920 ul/kg American Industrial Hygiene Association Journal. Vol. 23, Pg. 95, 1962. | |
| Dermal Toxicity: | |
|
skin-rabbit LD50 1770 ul/kg American Industrial Hygiene Association Journal. Vol. 23, Pg. 95, 1962. | |
| Inhalation Toxicity: | |
|
inhalation-rat LCLo 2000 ppm/4H American Industrial Hygiene Association Journal. Vol. 23, Pg. 95, 1962. | |
Safety in Use Information:
| Category: | natural substances and extractives | ||
| Recommendation for 3-ethoxybutyraldehyde diethyl acetal usage levels up to: | |||
| not for fragrance use. | |||
| Recommendation for 3-ethoxybutyraldehyde diethyl acetal flavor usage levels up to: | |||
| not for flavor use. | |||
Safety References:
| EPI System: | View |
| AIDS Citations: | Search |
| Cancer Citations: | Search |
| Toxicology Citations: | Search |
| EPA ACToR: | Toxicology Data |
| EPA Substance Registry Services (SRS): | Registry |
| Laboratory Chemical Safety Summary : | 22163 |
| National Institute of Allergy and Infectious Diseases: | Data |
| 1,1,3-triethoxybutane | |
| Chemidplus: | 0005870826 |
References:
| 1,1,3-triethoxybutane | |
| NIST Chemistry WebBook: | Search Inchi |
| Pubchem (cid): | 22163 |
| Pubchem (sid): | 134986876 |
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 |
| VCF-Online: | VCF Volatile Compounds in Food |
| ChemSpider: | View |
Potential Blenders and core components note
| None Found | ||
Potential Uses:
| None Found |
Occurrence (nature, food, other): note
| brandy Search PMC Picture | |
| rum Search PMC Picture |
Synonyms:
| butane, 1,1,3-triethoxy- | |
| butyraldehyde, 3-ethoxy-, diethyl acetal | |
| butyraldehyde, 3-ethoxy-, diethyl acetal (8CI) | |
| 1,1,3- | triethoxybutane |