| 2D: |  |
|---|---|
| 3D: | |
| CAS Number: | 60308-76-1 |
| ECHA EC Number: | 262-156-8 |
| FDA UNII: | Search |
| Category: | flavor and fragrance agents |
| IUPAC Name: | (E)-4-ethyl-2-octenoic acid |
| InChI : | InChI=1/C10H18O2/c1-3-5-6-9(4-2)7-8-10(11)12/h7-9H,3-6H2,1-2H3,(H,11,12)/b8-7+ |
| Std.InChI: | InChI=1S/C10H18O2/c1-3-5-6-9(4-2)7-8-10(11)12/h7-9H,3-6H2,1-2H3,(H,11,12)/b8-7+ |
| InChIKey : | RTSYTZNKRVDRRT-BQYQJAHWBG |
| Std.InChIKey: | RTSYTZNKRVDRRT-BQYQJAHWSA-N |
| SMILES : | CCCCC(CC)/C=C/C(=O)O |
| Molar Refractivity : | 49.95 ± 0.3 cm3 (est) |
| Parachor : | 436.3 ± 4.0 cm3 (est) |
| Index of Refraction : | 1.460 ± 0.02 (est) |
| Surface Tension : | 32.8 ± 3.0 dyne/cm (est) |
| Density : | 0.934 ± 0.06 g/cm3 (est) |
| Polarizability : | 19.80 ± 0.5 10-24cm3 (est) |
| Assay: | 95.00 to 100.00 |
| Food Chemicals Codex Listed: | No |
| Boiling Point: | 271.00 to 273.00 °C. @ 760.00 mm Hg (est) |
| Vapor Pressure: | 0.002000 mmHg @ 25.00 °C. (est) |
| Flash Point: | 354.00 °F. TCC ( 178.70 °C. ) (est) |
| logP (o/w): | 3.559 (est) |
| Soluble in: | |
| alcohol | |
| water, 99.93 mg/L @ 25 °C (est) | |
| Insoluble in: | |
| water | |
| None found |
| None found |
| 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: | |||
| flavor and fragrance agents | |||
| RIFM Fragrance Material Safety Assessment: Search | |||
| IFRA Code of Practice Notification of the 49th Amendment to the IFRA Code of Practice | |||
| EPI System: View |
| AIDS Citations:Search |
| Cancer Citations:Search |
| Toxicology Citations:Search |
| EPA Substance Registry Services (TSCA):60308-76-1 |
| EPA ACToR:Toxicology Data |
| EPA Substance Registry Services (SRS):Registry |
| Laboratory Chemical Safety Summary :5916286 |
| National Institute of Allergy and Infectious Diseases:Data |
| (E)-4-ethyloct-2-enoic acid |
| Chemidplus:0060308761 |
| (E)-4-ethyloct-2-enoic acid | |
| NIST Chemistry WebBook: | Search Inchi |
| Canada Domestic Sub. List: | 60308-76-1 |
| Pubchem (cid): | 5916286 |
| Pubchem (sid): | 135065166 |
| (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 |
| None Found |
| None Found |
| not found in nature |
| (E)-4- | ethyl oct-2-enoic acid |
| (E)-4- | ethyl-oct-2-enoic acid |
| (2E)-4- | ethyloct-2-enoic acid |
| (E)-4- | ethyloct-2-enoic acid |
| 2- | octenoic acid, 4-ethyl-, (2E)- |
| 2- | octenoic acid, 4-ethyl-, (E)- |
| None found yet. Try the PubMed Search. |
