Articles:
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2-pentene, 2,4,4-trimethyl-
Notes:
None found
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| CAS Number: | 107-40-4 |  3D/inchi
|
| ECHA EINECS - REACH Pre-Reg: | 203-488-5 | |
| FDA UNII: | 548R0DU21I | |
| Nikkaji Web: | J3.613G | |
| Beilstein Number: | 1719492 | |
| MDL: | MFCD00008902 | |
| XlogP3-AA: | 3.60 (est) | |
| Molecular Weight: | 112.21552000 | |
| Formula: | C8 H16 | |
| BioActivity Summary: | listing | |
| 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 liquid (est) |
| Assay: | 95.00 to 100.00 % |
| Food Chemicals Codex Listed: | No |
| Specific Gravity: | 0.72200 to 0.72300 @ 20.00 °C. |
| Pounds per Gallon - (est).: | 6.015 to 6.023 |
| Refractive Index: | 1.41500 to 1.41700 @ 20.00 °C. |
| Melting Point: | -106.30 °C. @ 760.00 mm Hg (est) |
| Boiling Point: | 104.90 °C. @ 760.00 mm Hg |
| Vapor Pressure: | 35.100000 mmHg @ 25.00 °C. (est) |
| Flash Point: | 29.00 °F. TCC ( -1.67 °C. ) |
| logP (o/w): | 4.140 (est) |
| Soluble in: | |
| water, 11.91 mg/L @ 25 °C (est) | |
Organoleptic Properties:
| Odor and/or flavor descriptions from others (if found). | |
Cosmetic Information:
| None found |
Suppliers:
| Santa Cruz Biotechnology |
| For experimental / research use only. |
| 2,4,4-Trimethyl-2-pentene ≥96% |
| Sigma-Aldrich: Aldrich |
| For experimental / research use only. |
| 2,4,4-Trimethyl-2-pentene 99% |
| TCI AMERICA |
| For experimental / research use only. |
| 2,4,4-Trimethyl-2-pentene >98.0%(GC) |
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: | |
| Not determined | |
| Dermal Toxicity: | |
| Not determined | |
| Inhalation Toxicity: | |
| Not determined | |
Safety in Use Information:
| Category: | natural substances and extractives | ||
| Recommendation for 2,4,4-trimethyl-2-pentene usage levels up to: | |||
| not for fragrance use. | |||
| Recommendation for 2,4,4-trimethyl-2-pentene flavor usage levels up to: | |||
| not for flavor use. | |||
Safety References:
| EPI System: | View |
| NIOSH International Chemical Safety Cards: | search |
| EPA Substance Registry Services (TSCA): | 107-40-4 |
| EPA ACToR: | Toxicology Data |
| EPA Substance Registry Services (SRS): | Registry |
| Laboratory Chemical Safety Summary : | 7869 |
| National Institute of Allergy and Infectious Diseases: | Data |
| WGK Germany: | 2 |
| 2,4,4-trimethylpent-2-ene | |
| Chemidplus: | 0000107404 |
References:
| 2,4,4-trimethylpent-2-ene | |
| NIST Chemistry WebBook: | Search Inchi |
| Canada Domestic Sub. List: | 107-40-4 |
| Pubchem (cid): | 7869 |
| Pubchem (sid): | 134972422 |
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 |
| CHEMBL: | View |
| HMDB (The Human Metabolome Database): | Search |
| Export Tariff Code: | 2901.29.5000 |
| VCF-Online: | VCF Volatile Compounds in Food |
| ChemSpider: | View |
| Formulations/Preparations: grade: 95%. | |
Potential Blenders and core components note
| None Found | ||
Potential Uses:
| None Found |
Occurrence (nature, food, other): note
| found in nature |
Synonyms:
| 2- | pentene, 2,4,4-trimethyl- |
| propene, 1-tert-butyl-2-methyl- | |
| 2,4,4- | trimethyl pent-2-ene |
| 2,4,4- | trimethylpent-2-ene |