Articles:
| None found yet. Try the PubMed Search. |
3-methylbutyl 2-octynoate
Notes:
None found
-
TCI AMERICA Moving Your Chemistry Forward We continuously strive to advance our technology. With East & West Coast distribution centers, count on TCI to deliver products quickly and reliably. Over 30,000 Reagents available today in benchtop to bulk quantities. We also offer custom synthesis solutions. Sign up for a TCI account today for fast and free shipping! Tokyo Chemical Industry Co., Ltd. (TCI) is a leading worldwide manufacturer of specialty organic chemicals founded in 1946. TCI provides organic laboratory chemicals as well as pharmaceutical, cosmetic and functional materials. More than 70 years of synthesis experience and multi-purpose plants enable TCI to offer more than 30,000 products as well as custom synthesis. US Email: Sales Email: Technical Support Voice: 1-800-423-8616 Fax: 1- 888-520-1075 Facebook Twitter Instagram Linkedin Product(s): O0254 Isoamyl 2-Octynoate min. 97.0 %
-
| CAS Number: | 68555-60-2 |  3D/inchi
|
| ECHA EINECS - REACH Pre-Reg: | 271-436-9 | |
| Nikkaji Web: | J309.197J | |
| MDL: | MFCD00036670 | |
| XlogP3-AA: | 4.90 (est) | |
| Molecular Weight: | 210.31674000 | |
| Formula: | C13 H22 O2 | |
| NMR Predictor: | Predict (works with chrome or firefox) | |
Category: information only not used for fragrances or flavors
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 clear liquid (est) |
| Assay: | 95.00 to 100.00 % |
| Food Chemicals Codex Listed: | No |
| Specific Gravity: | 0.89400 to 0.89700 @ 20.00 °C. |
| Pounds per Gallon - (est).: | 7.448 to 7.473 |
| Refractive Index: | 1.44900 to 1.45200 @ 20.00 °C. |
| Boiling Point: | 292.00 to 294.00 °C. @ 760.00 mm Hg |
| Boiling Point: | 148.00 to 149.00 °C. @ 20.00 mm Hg |
| Vapor Pressure: | 0.002000 mmHg @ 25.00 °C. (est) |
| Flash Point: | 249.00 °F. TCC ( 120.56 °C. ) |
| logP (o/w): | 5.102 (est) |
| Soluble in: | |
| alcohol | |
| water, 5.609 mg/L @ 25 °C (est) | |
| Insoluble in: | |
| water | |
| Similar Items: note | |
| allyl heptine carbonate | |
| butyl heptine carbonate | |
| methyl heptine carbonate | |
Organoleptic Properties:
| Odor Type: green | |
| Odor Strength: | medium |
| Substantivity: | 164 hour(s) at 100.00 % |
| sweet leafy violet green | |
| Odor Description: at 100.00 %. | sweet leaf violet green Luebke, William tgsc, (1988) |
| Odor and/or flavor descriptions from others (if found). | |
Cosmetic Information:
| None found |
Suppliers:
| Santa Cruz Biotechnology |
| For experimental / research use only. |
| Isoamyl 2-octynoate |
| TCI AMERICA |
| For experimental / research use only. |
| Isoamyl 2-Octynoate min. 97.0 % |
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: | information only not used for fragrances or flavors | ||
| IFRA Critical Effect: | Insufficient data | ||
| IFRA: | View Standard | ||
| Recommendation for isoamyl heptine carbonate usage levels up to: | |||
| PROHIBITED: Should not be used as a fragrance ingredient. | |||
| Recommendation for isoamyl heptine carbonate 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): | 68555-60-2 |
| EPA ACToR: | Toxicology Data |
| EPA Substance Registry Services (SRS): | Registry |
| Laboratory Chemical Safety Summary : | 110542 |
| National Institute of Allergy and Infectious Diseases: | Data |
| 3-methylbutyl oct-2-ynoate | |
| Chemidplus: | 0068555602 |
References:
| 3-methylbutyl oct-2-ynoate | |
| NIST Chemistry WebBook: | Search Inchi |
| Pubchem (cid): | 110542 |
| Pubchem (sid): | 135068650 |
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 |
| Export Tariff Code: | 2916.19.5000 |
| ChemSpider: | View |
Potential Blenders and core components note
| None Found | ||
Potential Uses:
| foliage | FR | |
| lilac | FR | |
| sweet pea | FR | |
| violet | FR | |
| violet leaf | FR |
Occurrence (nature, food, other): note
| not found in nature |
Synonyms:
| iso | amyl 2-octynoate |
| amyl heptin carbonate | |
| 3- | methyl butyl 2-octynoate |
| 3- | methyl butyl oct-2-ynoate |
| 3- | methylbutyl 2-octynoate |
| 3- | methylbutyl oct-2-ynoate |
| 2- | octynoic acid 3-methyl butyl ester |
| 2- | octynoic acid 3-methylbutyl ester |
| 2- | octynoic acid isoamyl ester |
| 2- | octynoic acid, 3-methylbutyl ester |